2,2,6,6-tetramethyl-4-oxopiperidinooxy
fo-4c3ff65c4a3b9a2e
Identity
- Type
- Neutral molecule
- CAS
- 2896-70-0
- EC
- 220-778-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
53- (2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)oxidanyl
- 1-Oxyl-2,2,6,6-tetramethyl-4-oxopiperidine
- 1-Oxyl-2,2,6,6-tetramethyl-4-piperidone
- 1-Oxyl-2,2,6,6-tetramethylpiperidin-4-one
- 1-Piperidinyloxy, 2,2,6,6-tetramethyl-4-oxo-
- 2,2,6,6-Tetramethyl-4-oxo-1-piperidinooxy
- 2,2,6,6-tetramethyl-4-oxo-1-piperidinyloxy
- 2,2,6,6-Tetramethyl-4-oxo-1-piperidinyloxyl
- 2,2,6,6-tetramethyl-4-oxo-piperidin-1-oxyl
- 2,2,6,6-Tetramethyl-4-oxo-piperydin-1-oxyl
- 2,2,6,6-Tetramethyl-4-oxopiperidin-1-oxyl
- 2,2,6,6-Tetramethyl-4-oxopiperidin-1-oxyl radical
- 2,2,6,6-Tetramethyl-4-oxopiperidine-1-oxyl
- 2,2,6,6-Tetramethyl-4-oxopiperidine-1-oxyl radical
- 2,2,6,6-Tetramethyl-4-oxypiperidin-1-oxyl
- 2,2,6,6-Tetramethyl-4-piperidinone oxide
- 2,2,6,6-Tetramethyl-4-piperidinone-1-oxyl
- 2,2,6,6-Tetramethyl-4-piperidon-1-oxyl
- 2,2,6,6-tetramethyl-4-piperidone 1-nitroxide
- 2,2,6,6-tetramethyl-4-piperidone N-oxide
- 2,2,6,6-tetramethyl-4-piperidone nitroxide
- 2,2,6,6-tetramethyl-4-piperidone-N-oxy
- 2,2,6,6-Tetramethyl-4-piperidone-N-oxyl
- 2,2,6,6-Tetramethylpiperid-4-one-1-oxyl
- 2,2′,6,6′-Tetramethyl-4-oxopiperidine-1-oxyl
- 4-Oxo-2,2,6,6-tetramethyl-1-piperidinoxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidin-1-yl oxide
- 4-oxo-2,2,6,6-tetramethylpiperidine 1-oxyl free radical
- 4-oxo-2,2,6,6-tetramethylpiperidine-1-oxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidine-N-oxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidino-1-oxy
- 4-Oxo-2,2,6,6-tetramethylpiperidino-N-oxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidinooxy
- 4-Oxo-2,2,6,6-tetramethylpiperidinooxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidinoxyl
- 4-Oxo-2,2,6,6-tetramethylpiperidinyl-1-oxy
- 4-Oxo-2,2,6,6-tetramethylpiperidinyloxy
- 4-oxo-2,2,6,6-tetramethylpiperidinyloxyl
- 4-Oxo-TEMPO
- 4-oxo-TEMPO free radical
- 702
- Nitroxyl 1
- OTEMPO
- Piperidinooxy, 2,2,6,6-tetramethyl-4-oxo-
- TAN
- TAN (radical)
- TANO
- Tanone
- Tanone radical
- TEMPONE
- Tetramethyl-2,2,6,6-aza-1-cyclohexanone-4-oxide-1
- triacetoneamine N-oxyl
- triacetoneamine nitroxide
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | WSGDRFHJFJRSFY-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3 |
| Molecular formula chemrof:molecular_formula | C9H16NO2 |
| Molecular mass chemrof:molecular_mass | 170.232 |
| Monoisotopic mass chemrof:monoisotopic_mass | 170.1181, 170.118104 |
| SMILES string chemrof:smiles_string | CC1(C)CC(=O)CC(C)(C)N1[O] |
Known URLs
23Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=2896-70-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:180665 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.018.890 | enrich_references.pubchem_identifier_url |
| ChemSpider | https://www.chemspider.com/Chemical-Structure.454261.html | enrich_references.chebi_xrefs |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4044905 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL606972 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7W1863PEH5 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J162G | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.763.955K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/520789 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/10072473 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20028825 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22571288 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/233304 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27377643 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/30089385 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/4355922 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/5790116 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/6508859 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/7070387 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/9719601 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1818579 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q27268928 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 6a331950-ebf6-4c1d-97a3-83c6db9ea285 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 8dfa2192-af44-419a-af3e-ebd41995994f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 1efb9b88-5250-4aa7-a18a-f447ae8e4b85 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 51f2cda4-9dfb-4606-904b-25a2ee67ae4c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| f3a2b957-eb48-44e8-866a-8d2c4815bacc | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| db1e19f1-c4c3-4fef-8737-b508700b0099 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| c18ee96d-2e68-42d2-aa08-40afa09a3c02 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| e9a721f6-fe14-4e2e-9fa1-4253df568a01 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 83ad6b7e-e004-4342-b06f-1f8aef89221e | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| aba9f77b-e0a0-4c4e-b57b-80840decbce1 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 391f99e8-f845-4b90-8c6f-a56830b558ea | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 62133275-395d-4b40-8a42-7d37b551f45f | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| ddc2b7b0-d714-4927-906c-561ac0b399c9 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-4c3ff65c4a3b9a2e",
"prefLabel": [
{
"@value": "2,2,6,6-tetramethyl-4-oxopiperidinooxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "(2,2,6,6-tetramethyl-4-oxopiperidin-1-yl)oxidanyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "1-Oxyl-2,2,6,6-tetramethyl-4-oxopiperidine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1-Oxyl-2,2,6,6-tetramethyl-4-piperidone",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1-Oxyl-2,2,6,6-tetramethylpiperidin-4-one",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1-Piperidinyloxy, 2,2,6,6-tetramethyl-4-oxo-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxo-1-piperidinooxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-oxo-1-piperidinyloxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxo-1-piperidinyloxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-oxo-piperidin-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxo-piperydin-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxopiperidin-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxopiperidin-1-oxyl radical",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxopiperidine-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxopiperidine-1-oxyl radical",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-oxypiperidin-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-piperidinone oxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-piperidinone-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-piperidon-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-piperidone 1-nitroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-piperidone N-oxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-piperidone nitroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-tetramethyl-4-piperidone-N-oxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "2,2,6,6-Tetramethyl-4-piperidone-N-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,6,6-Tetramethylpiperid-4-one-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2′,6,6′-Tetramethyl-4-oxopiperidine-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethyl-1-piperidinoxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidin-1-yl oxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-oxo-2,2,6,6-tetramethylpiperidine 1-oxyl free radical",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "4-oxo-2,2,6,6-tetramethylpiperidine-1-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidine-N-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidino-1-oxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidino-N-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidinooxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidinooxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidinoxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidinyl-1-oxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-Oxo-2,2,6,6-tetramethylpiperidinyloxy",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-oxo-2,2,6,6-tetramethylpiperidinyloxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "4-Oxo-TEMPO",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "4-oxo-TEMPO free radical",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "702",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Nitroxyl 1",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "OTEMPO",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Piperidinooxy, 2,2,6,6-tetramethyl-4-oxo-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "TAN",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "TAN (radical)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "TANO",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Tanone",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Tanone radical",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "TEMPONE",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Tetramethyl-2,2,6,6-aza-1-cyclohexanone-4-oxide-1",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:2896-70-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "triacetoneamine N-oxyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "triacetoneamine nitroxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C9H16NO2"
],
"attested_by": {
"C9H16NO2": [
"enrich_references.chebi_semantic",
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.generalized_empirical_formula"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
],
"attested_by": {
"CC1(C)CC(=O)CC(C)(C)N1[O]": [
"enrich_references.chebi_semantic",
"rdkit_post_consensus"
],
"CC1(CC(=O)CC(N1[O])(C)C)C": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "SMILES",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.smiles_string"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3"
],
"attested_by": {
"InChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3": [
"enrich_references.chebi_semantic",
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChI",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.inchi_string"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"WSGDRFHJFJRSFY-UHFFFAOYSA-N"
],
"attested_by": {
"WSGDRFHJFJRSFY-UHFFFAOYSA-N": [
"enrich_references.chebi_semantic",
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.inchi_key_string"
},
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"@value": [
170.232
],
"attested_by": {
"170.232": [
"enrich_references.chebi_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular mass",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.mass"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"@value": [
170.1181,
170.118104
],
"attested_by": {
"170.1181": [
"enrich_references.chebi_semantic"
],
"170.118104": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"rdfs:label": "Monoisotopic mass",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.monoisotopic_mass"
},
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1(C)CC(=O)CC(C)(C)N1[O]"
]
}
]
},
"https://w3id.org/chemrof/elemental_charge": {
"@id": "https://w3id.org/chemrof/elemental_charge",
"@value": [
0
],
"attested_by": {
"0": [
"enrich_references.chebi_semantic"
]
},
"rdfs:label": "Elemental charge",
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/NUM",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.basic_property_values.charge"
}
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J162G",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.763.955K",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.018.890",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=2896-70-0",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID4044905",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7W1863PEH5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/520789",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.by_cas[2896-70-0]"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/10072473",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/20028825",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/22571288",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/233304",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/27377643",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/30089385",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/4355922",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/5790116",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/6508859",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/7070387",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://pubmed.ncbi.nlm.nih.gov/9719601",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://www.chemspider.com/Chemical-Structure.454261.html",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
},
{
"@id": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:180665",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_id_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.id"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL606972",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27268928",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:520789;CAS:2896-70-0"
],
"prov:wasDerivedFrom": "pubchem.identifiers[2896-70-0]"
}
},
{
"@id": "reaxys:1818579",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_xrefs",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.xrefs_urls"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1efb9b88-5250-4aa7-a18a-f447ae8e4b85",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "neutral_molecule",
"reason": "",
"types": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"2896-70-0"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=2896-70-0"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"220-778-7"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=220-778-7"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"http://www.w3.org/2004/02/skos/core#definition": [
{
"@value": "A member of the class of aminoxyls that is TEMPO carrying an oxo group at position 4.",
"@language": "en",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_definition",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_180665"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}
Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works