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Norcotinine

MNXM8947 is deprecated and here replaced by MNXM741161
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM741161 Image of MNXM741161
referencechebi:89406
formulaC9H10N2O
global charge0
mol weight162.192
InChIKeyFXFANIORDKRCCA-UHFFFAOYSA-N
InChIInChI=1S/C9H10N2O/c12-9-4-3-8(11-9)7-2-1-5-10-6-7/h1-2,5-6,8H,3-4H2,(H,11,12)
SMILESO=C1CCC(C2=CN=CC=C2)N1
MNX internals
InChI (mnx)InChI=1/C9H10N2O/c12-9-4-3-8(11-9)7-2-1-5-10-6-7/h1-2,5-6,8H,3-4H2,(H,11,12)/t8? Image of MNXM741161
SMILES (mnx)[CH:1]1=[CH:2][C:7]([CH:8]2[CH2:3][CH2:4][C:9]([OH:12])=[N:11]2)=[CH:6][N:10]=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:89406
chebi:89406
FXFANIORDKRCCA-UHFFFAOYSA-N 		Norcotinine
(RS)-Norcotinine
5-(3-Pyridinyl)-2-Pyrrolidinone
5-(pyridin-3-yl)pyrrolidin-2-one
Demethylcotinine
hmdb:HMDB0001297
FXFANIORDKRCCA-UHFFFAOYSA-N 		Norcotinine
(RS)-Norcotinine
5-(3-Pyridinyl)-2-pyrrolidinone
5-(pyridin-3-yl)pyrrolidin-2-one
5-pyridin-3-ylpyrrolidin-2-one
Demethylcotinine
Norcotinine, (+-)-isomer
Norcotinine, (R)-isomer
Norcotinine, (S)-isomer

hmdb:HMDB01297 		secondary/obsolete/fantasy identifier