CHEBI:177590 - 3'-Hydroxycotinine, Cis-

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3'-Hydroxycotinine, Cis-
ChEBI ID CHEBI:177590
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C10H12N2O2
Net Charge 0
Average Mass 192.218
Monoisotopic Mass 192.08988
InChI InChI=1S/C10H12N2O2/c1-12-8(5-9(13)10(12)14)7-3-2-4-11-6-7/h2-4,6,8-9,13H,5H2,1H3/t8-,9-/m0/s1
InChIKey XOKCJXZZNAUIQN-IUCAKERBSA-N
SMILES O[C@H]1C[C@H](N(C1=O)C)C=2C=CC=NC2
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in Sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing 3'-Hydroxycotinine, Cis- (CHEBI:177590) is a pyridines (CHEBI:26421)
3'-Hydroxycotinine, Cis- (CHEBI:177590) is a pyrrolidines (CHEBI:38260)
IUPAC Name
(3S,5S)-3-hydroxy-1-methyl-5-pyridin-3-ylpyrrolidin-2-one
Manual Xref Database
9461971 ChemSpider
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Registry Number Type Source
37096-14-3 CAS Registry Number ChemIDplus