1-amyl-1-nitrosourea

UUID 08a91e70-3ddc-11dd-a31d-0050c2490048

Flow Object ID fo-b261064c1453c38e

Source EF 3.1

Context Environmental → Air → Ground level → Urban (>1000 people/square mile)

CAS Numbers 10589-74-9

prefLabel

Language	Value	Provenance
`en`	`1-amyl-1-nitrosourea`

altLabel ⓘ

Language	Value	Provenance
`en`	`<em>N</em>-Amyl-<em>N</em>-nitrosourea`
`en`	`<em>N</em>-Nitroso-<em>N</em>-pentylurea`
`en`	`<em>N</em>-Pentyl-<em>N</em>-nitrosourea`
`en`	`Urea, 1-nitroso-1-pentyl-`
`en`	`Urea, <em>N</em>-nitroso-<em>N</em>-pentyl-`

References

Shared Properties

Predicate	Value
InChIKey	`LOJPGRHPJBGMMF-CNZSLQMUSA-N, YYTNAQDGJQPZFU-UHFFFAOYSA-N`
InChI	`InChI=1S/C25H40O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-16,18-22,27H,5-14H2,1-4H3/t15-,16-,18+,19-,20+,21+,22+,24+,25-/m1/s1, InChI=1S/C6H13N3O2/c1-2-3-4-5-9(8-11)6(7)10/h2-5H2,1H3,(H2,7,10)`
IUPAC name	(4R)-4-[(5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester, (4R)-4-[(5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-3-keto-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]valeric acid methyl ester, 1-amyl-1-nitroso-urea, 1-nitroso-1-pentyl-urea, 1-nitroso-1-pentylurea, methyl (4R)-4-[(5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-12-oxidanyl-3-oxidanylidene-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate, methyl (4R)-4-[(5R,8R,9S,10S,12S,13R,14S,17R)-12-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
Molecular formula	`C25H40O4, C6H13N3O2`
SMILES	`CC(CCC(=O)OC)C1CCC2C1(C(CC3C2CCC4C3(CCC(=O)C4)C)O)C, CCCCCN(C(=O)N)N=O, C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)O)C`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`08a91e70-3ddc-11dd-a31d-0050c2490048`	1-amyl-1-nitrosourea

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	1-amyl-1-nitrosourea	Emissions/Emissions to air/Emissions to urban air close to ground	kg	`exactMatch`	—

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	1	`—`	consensus_match	group_key=1-amyl-1-nitrosourea\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=10589-74-9; added Common Chemistry CAS names as altLabel: <em>N</em>-Amyl-<em>N</em>-nitrosourea, <em>N</em>-Nitroso-<em>N</em>-pentylurea, <em>N</em>-Pentyl-<em>N</em>-nitrosourea, Urea, 1-nitroso-1-pentyl-, Urea, <em>N</em>-nitroso-<em>N</em>-pentyl-; object_uuid=fo-b261064c1453c38e
`cas_match_labels`	1	`—`	consensus_match	group_key=1-amyl-1-nitrosourea\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'10589-74-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b261064c1453c38e: {'10589-74-9': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Ground level
population_density	Urban (>1000 people/square mile)

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '<em>N</em>-Amyl-<em>N</em>-nitrosourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10589-74-9', 'https://commonchemistry.cas.org/detail?cas_rn=10589-74-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-Nitroso-<em>N</em>-pentylurea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10589-74-9', 'https://commonchemistry.cas.org/detail?cas_rn=10589-74-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>-Pentyl-<em>N</em>-nitrosourea', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10589-74-9', 'https://commonchemistry.cas.org/detail?cas_rn=10589-74-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Urea, 1-nitroso-1-pentyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10589-74-9', 'https://commonchemistry.cas.org/detail?cas_rn=10589-74-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Urea, <em>N</em>-nitroso-<em>N</em>-pentyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:10589-74-9', 'https://commonchemistry.cas.org/detail?cas_rn=10589-74-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=1-amyl-1-nitrosourea\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=10589-74-9; added Common Chemistry CAS names as altLabel: <em>N</em>-Amyl-<em>N</em>-nitrosourea, <em>N</em>-Nitroso-<em>N</em>-pentylurea, <em>N</em>-Pentyl-<em>N</em>-nitrosourea, Urea, 1-nitroso-1-pentyl-, Urea, <em>N</em>-nitroso-<em>N</em>-pentyl-; object_uuid=fo-b261064c1453c38e
`cas_match_labels`	`None`	`{'10589-74-9': 'exactMatch'}`	group_key=1-amyl-1-nitrosourea\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'10589-74-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b261064c1453c38e: {'10589-74-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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