cotinine N-oxideImported
An N-alkylpyrrolidine that is nicotine in which the methylene hydrogens at position 2 on the pyrrolidine ring have been replaced by an oxo group and the pyridine nitrogen converted into the corresponding N-oxide. A minor metabolite of nicotine.
Defined bychebi
Exact Synonyms
(5S)-1-methyl-5-(1-oxo-1lambda(5)-pyridin-3-yl)pyrrolidin-2-one
Related Synonyms
(-)-cotinine N-oxide
(5S)-1-methyl-5-(1-oxido-3-pyridinyl)-2-pyrrolidinone
(S)-1-methyl-5-(1-oxido-3-pyridinyl)-2-Pyrrolidinone
(S)-1-methyl-5-(3-pyridinyl)-2-Pyrrolidinone N-oxide
3-[(2S)-1-methyl-5-oxopyrrolidin-2-yl]pyridin-1-ium-1-olate
Cotinine-N-oxide
class Information
charge
0
formula
C10H12N2O2
has_dbxref
- CAS:36508-80-2
- HMDB:HMDB0001411
- MetaCyc:CPD-3185
- PMID:1478978
- PMID:15109883
- PMID:1521032
- PMID:15472033
- PMID:16359169
- PMID:17640086
- PMID:19065315
- PMID:19466395
- PMID:20097626
- PMID:20301889
- PMID:20822672
- PMID:20980010
- PMID:21452992
- PMID:21719221
- PMID:23022114
- PMID:23318728
- PMID:23737496
- PMID:23983622
- PMID:24755743
- PMID:24968308
- PMID:25013964
- PMID:25304849
- PMID:26721601
- PMID:27480511
- PMID:3443673
- PMID:4625531
- PMID:8294547
- Reaxys:6479802
has_obo_namespace
chebi_ontology
inchikey
CIPULDKLIIVIER-VIFPVBQESA-N
inchi
InChI=1S/C10H12N2O2/c1-11-9(4-5-10(11)13)8-3-2-6-12(14)7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1
in_subset
mass
192.215
monoisotopicmass
192.08988
smiles
CN1[C@@](CCC1=O)(C2=C[N+](=CC=C2)[O-])[H]