Nicotinamide
fo-33cafe676c2230de
Identity
- Type
- Neutral molecule
- CAS
- 98-92-0
- EC
- 202-713-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
52- 3-(Aminocarbonyl)pyridine
- 3-Amidopyridine
- 3-carbamoylpyridine
- 3-pyridinecarboxamide
- 3-Pyridinecarboxylic acid amide
- Aminicotin
- Benicot
- beta-pyridinecarboxamide
- Delonin Amide
- Dipegyl
- m-(aminocarbonyl)pyridine
- Macamin NC
- NAM
- Niacinamide
- niamide
- Niavit PP
- Nicamina
- Nicamindon
- Nicasir
- Nicobion
- Nicofort
- Nicosan 2
- Nicosylamide
- Nicotilamide
- Nicotinamid
- nicotinamida
- nicotinamidum
- nicotine acid amide
- nicotine amide
- nicotinic acid amide
- nicotinic amide
- Nicotinsaeureamid
- nicotylamide
- Nicovit
- Nicovitina
- Nictoamide
- Nikotinamid
- Nikotinsaeureamid
- Niocinamide
- Niozymin
- Papulex
- Pelmin
- Pelmine
- Pelonin amide
- pyridine-3-carboxamide
- pyridine-3-carboxylic acid amide
- Vi-Nicotyl
- Vitamin B
- Vitamin B3 (niacinamide)
- Vitamin B3 (nicotinamide)
- Vitamin PP
- β-Pyridinecarboxamide
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | DFPAKSUCGFBDDF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9) |
| IUPAC name chemrof:IUPAC_name | Nicotinamide |
| Molecular formula chemrof:molecular_formula | C6H6N2O |
| Molecular mass chemrof:molecular_mass | 122.127 |
| Monoisotopic mass chemrof:monoisotopic_mass | 122.04801, 122.048013 |
| SMILES string chemrof:smiles_string | NC(=O)c1cccnc1 |
Known URLs
114Where 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=11032-50-1 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=98-92-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:17154 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.467 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.031.138 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1703 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2020929 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB02701 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB02701 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:1906 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/1906 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=13128 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=27452 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=759115 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1140 | enrich_references.pubchem_identifier_url |
| foodb.food | foodb.food:FDB012485 | enrich_references.chebi_xrefs |
| gmelin | gmelin:3336 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/25X51I8RD4 | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0001406 | enrich_references.chebi_xrefs |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2936.29.16.30 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.988H | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C00153 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D00036 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C00153 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D00036 | enrich_references.pubchem_identifier_url |
| knapsack | knapsack:C00000209 | enrich_references.chebi_xrefs |
| lincs.smallmolecule | lincs.smallmolecule:LSM-5428 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37778 | enrich_references.pubchem_identifier_url |
| MetaCyc | https://metacyc.org/compound?orgid=META&id=NIACINAMIDE | enrich_references.chebi_xrefs |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C2327 | enrich_references.pubchem_identifier_url |
| patent | patent:US2904552 | enrich_references.chebi_xrefs |
| patent | patent:US2993051 | enrich_references.chebi_xrefs |
| pdb-ccd | pdb-ccd:NCA | enrich_references.chebi_xrefs |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL1140 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/936 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=008919 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/10884473 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11355130 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11814060 | enrich_references.chebi_xrefs |
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| PubMed | https://pubmed.ncbi.nlm.nih.gov/12487919 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/12519385 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/12709297 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/12782109 | enrich_references.chebi_xrefs |
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| PubMed | https://pubmed.ncbi.nlm.nih.gov/15780941 | enrich_references.chebi_xrefs |
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| PubMed | https://pubmed.ncbi.nlm.nih.gov/22407380 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22456321 | enrich_references.chebi_xrefs |
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| PubMed | https://pubmed.ncbi.nlm.nih.gov/22626821 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22699421 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22709272 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22763693 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22770225 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23016598 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23028781 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23043891 | enrich_references.chebi_xrefs |
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| PubMed | https://pubmed.ncbi.nlm.nih.gov/24559077 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24635573 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25504347 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25561219 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/31710686 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/32249824 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/33196157 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/33471934 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8620561 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8767167 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/9518388 | enrich_references.chebi_xrefs |
| reaxys | reaxys:383619 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/7405 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q192423 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Nicotinamide | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| eb2e1e0d-8436-44f1-9e4d-20f7ee8d41f0 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 5ab8951f-b8ae-414a-98c3-8a823045edfe | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 45bb061c-d7cd-42e9-a761-1c8b88ffcab3 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| c23e54f1-3888-464e-9a39-65565cb9efe2 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7aa4c20d-7aed-4bb2-b945-b8eb9ec4f02d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 4e8d6479-f9a0-453b-b905-75d227600c6b | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 6c5ae8b6-988c-4092-88bc-52ff8add7d0d | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| fe5bba6d-7b15-436b-a465-558b9ddfc0ae | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 081f4350-a0fb-41fa-8c36-30b32b92ef86 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| ca40ec3b-0fbf-46d9-9427-08d81a872216 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| aa04eb68-40eb-4907-ad76-6d21f72aa5f0 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 3b2531e5-7bab-4087-9de3-0ef91f3bda3a | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| fdda3791-636f-4dd6-8b4e-93996523640f | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-33cafe676c2230de",
"prefLabel": [
{
"@value": "Nicotinamide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "3-(Aminocarbonyl)pyridine",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:hadPrimarySource": [
"CAS:98-92-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "3-Amidopyridine",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:hadPrimarySource": [
"CAS:98-92-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "3-carbamoylpyridine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "3-pyridinecarboxamide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
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"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "3-Pyridinecarboxylic acid amide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Aminicotin",
"@language": "en",
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"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Benicot",
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"provenance": {
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "beta-pyridinecarboxamide",
"@language": "en",
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"provenance": {
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Delonin Amide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dipegyl",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "m-(aminocarbonyl)pyridine",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Macamin NC",
"@language": "en",
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"provenance": {
"prov:wasGeneratedBy": "consensus_match",
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"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "NAM",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Niacinamide",
"@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_17154"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "niamide",
"@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_17154"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Niavit PP",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:98-92-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=98-92-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Nicamina",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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}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