← Back to consensus flow objects
Niobium-95
| Flow Object ID | fo-b3e40b5b0d876bfc | ||||
|---|---|---|---|---|---|
| Type | Isotope | ||||
| prefLabel |
|
||||
| CAS Numbers | 13967-76-5 | ||||
| Parent Element | fo-7bb9ea94364f9458 | ||||
| Changes Applied | 12 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
GUCVJGMIXFAOAE-NJFSPNSNSA-N, ZQZIGZNGQHBUIN-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C14H15N3O3/c1-16-11-8-17(7-10-5-3-2-4-6-10)9-20-12(11)13(18)15-14(16)19/h2-6H,7-9H2,1H3,(H,15,18,19), InChI=1S/Nb/i1+2
|
| IUPAC name |
3-benzyl-5-methyl-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-dione, 3-benzyl-5-methyl-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-quinone, 5-methyl-3-(phenylmethyl)-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-dione, niobium-95
|
| Molecular formula |
C14H15N3O3, Nb
|
| SMILES |
CN1C2=C(C(=O)NC1=O)OCN(C2)CC3=CC=CC=C3, [95Nb], [Nb]
|
References
- https://commonchemistry.cas.org/detail?cas_rn=13967-76-5
- https://comptox.epa.gov/dashboard/DTXSID10160967
- https://comptox.epa.gov/dashboard/DTXSID40930539
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=101681
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W7PYZ2JZU3
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WD7KT071UV
- https://pubchem.ncbi.nlm.nih.gov/compound/104776
- https://pubchem.ncbi.nlm.nih.gov/compound/265547
- https://pubchem.ncbi.nlm.nih.gov/element/41
- https://pubchem.ncbi.nlm.nih.gov/rest/pug_view/data/element/41/JSON
- https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=126214
- https://www.chemlin.org
- https://www.chemlin.org/isotope/niobium-95m
- https://www.wikidata.org/wiki/Q82905935
- https://www.wikidata.org/wiki/Q83029327
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
32cbe901… |
EF 3.1 | kBq | Environmental → Air → Aircraft cruise height | 0 | 1 |
08a91e70… |
EF 3.1 | kBq | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
08a91e70… |
EF 3.1 | kBq | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 0 | 1 |
08a91e70… |
EF 3.1 | kBq | Environmental → Air → High stack, >150 meters | 0 | 1 |
08a91e70… |
EF 3.1 | kBq | Environmental → Air → Unknown | 0 | 1 |
2906b098… |
EF 3.1 | kBq | Environmental → Ground → Agricultural | 0 | 1 |
32cbe902… |
EF 3.1 | kBq | Environmental → Ground → Unknown | 0 | 1 |
32cbe903… |
EF 3.1 | kBq | Environmental → Water → Ocean | 0 | 1 |
32cbe900… |
EF 3.1 | kBq | Environmental → Water → Surface water | 0 | 1 |
32cbe905… |
EF 3.1 | kBq | Environmental → Water → Unknown | 0 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
08a91e70… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
08a91e70… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
08a91e70… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
08a91e70… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
2906b098… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe900… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe901… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe902… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe903… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe904… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe905… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
32cbe906… |
cas_match_labels |
— |
{"13967-76-5":"exactMatch"} |
group_key=niobium-95||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'13967-76-5': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b3e40b5b0d876bfc: {'13967-76-5': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-b3e40b5b0d876bfc",
"prefLabel": [
{
"@value": "Niobium-95",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C14H15N3O3",
"Nb"
],
"rdfs:label": "Molecular formula",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776",
"CID:265547"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"GUCVJGMIXFAOAE-NJFSPNSNSA-N",
"ZQZIGZNGQHBUIN-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776",
"CID:265547"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
}
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CN1C2=C(C(=O)NC1=O)OCN(C2)CC3=CC=CC=C3",
"[95Nb]",
"[Nb]"
],
"rdfs:label": "SMILES",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776",
"CID:265547"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C14H15N3O3/c1-16-11-8-17(7-10-5-3-2-4-6-10)9-20-12(11)13(18)15-14(16)19/h2-6H,7-9H2,1H3,(H,15,18,19)",
"InChI=1S/Nb/i1+2"
],
"rdfs:label": "InChI",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776",
"CID:265547"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"3-benzyl-5-methyl-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-dione",
"3-benzyl-5-methyl-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-quinone",
"5-methyl-3-(phenylmethyl)-2,4-dihydropyrimido[4,5-e][1,3]oxazine-6,8-dione",
"niobium-95"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776",
"CID:265547"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"relationships": {
"parent_element_flow_object_id": "fo-7bb9ea94364f9458",
"relationship_type": "isotope_of"
},
"isotope": {
"nuclide": "95Nbm",
"mass_number": 95,
"atomic_mass_and_uncertainty_u": "94.906831110 ± 0.000000545",
"half_life_and_uncertainty": "3.61 d ± 0.03",
"decay_modes": "IT=94.4±0.6%; β-=5.6±0.6%",
"discovery_year": "1948",
"specific_activity_bq_per_g": "1.423729791245e+16",
"specific_activity_bq_per_g_value": 1.423729791245e+16,
"half_life_chemlin": "3.61(3) d",
"chemlin_url": "https://www.chemlin.org/isotope/niobium-95m",
"metastable_resolution": {
"strategy": "longest_half_life",
"selected_slug": "niobium-95m",
"selected_half_life": "3.61(3) d",
"selected_half_life_days": 3.61,
"alternates": [],
"attempted_urls": [
"https://www.chemlin.org/isotope/niobium-95m",
"https://www.chemlin.org/isotope/niobium-95m1",
"https://www.chemlin.org/isotope/niobium-95m2",
"https://www.chemlin.org/isotope/niobium-95m3"
]
},
"symbol": "Nb",
"metastable": true
},
"isotope_lookup": {
"is_kbq_candidate": true,
"matched": true,
"matched_on": "Niobium-95",
"source": "pubchem_pug_view_annotation_heading",
"sources": [
"pubchem_pug_view_annotation_heading",
"https://www.chemlin.org"
],
"metastable_resolution": {
"strategy": "longest_half_life",
"selected_slug": "niobium-95m",
"selected_half_life": "3.61(3) d",
"selected_half_life_days": 3.61,
"alternates": [],
"attempted_urls": [
"https://www.chemlin.org/isotope/niobium-95m",
"https://www.chemlin.org/isotope/niobium-95m1",
"https://www.chemlin.org/isotope/niobium-95m2",
"https://www.chemlin.org/isotope/niobium-95m3"
]
}
}
},
"references": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=13967-76-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"13967-76-5"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID10160967",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID40930539",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=101681",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/W7PYZ2JZU3",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WD7KT071UV",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/104776",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[13967-76-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/265547",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[13967-76-5]"
}
},
"https://pubchem.ncbi.nlm.nih.gov/element/41",
"https://pubchem.ncbi.nlm.nih.gov/rest/pug_view/data/element/41/JSON",
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=126214",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
"https://www.chemlin.org",
"https://www.chemlin.org/isotope/niobium-95m",
{
"@id": "https://www.wikidata.org/wiki/Q82905935",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:104776;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q83029327",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:265547;CAS:13967-76-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[13967-76-5]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "08a91e70-3ddc-11dd-96d3-0050c2490048",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"13967-76-5"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=13967-76-5"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=13967-76-5"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null
}