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1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone

PropertiesImage
MNX_IDMNXM338920 Image of MNXM338920
referencechebi:126075
formulaC18H19N3O2
global charge0
mol weight309.369
InChIKeySSAZKPRPAYUHJV-LZLYRXPVSA-N
InChIInChI=1S/C18H19N3O2/c22-11-16-18-13-6-1-2-7-14(13)20-10-15(18)21(16)17(23)9-12-5-3-4-8-19-12/h1-8,15-16,18,20,22H,9-11H2/t15-,16+,18+/m0/s1
SMILESO=C(CC1=CC=CC=N1)N1[C@H](CO)[C@@H]2C3=CC=CC=C3NC[C@@H]21
MNX internals
InChI (mnx)InChI=1/C18H19N3O2/c22-11-16-18-13-6-1-2-7-14(13)20-10-15(18)21(16)17(23)9-12-5-3-4-8-19-12/h1-8,15-16,18,20,22H,9-11H2/t15-,16+,18+/m0/s1 Image of MNXM338920
SMILES (mnx)[CH:1]1=[CH:2][CH:7]=[C:14]2[C:13](=[CH:6]1)[C@@H:18]1[C@H:15]([CH2:10][NH:20]2)[N:21]([C:17]([CH2:9][C:12]2=[CH:5][CH:3]=[CH:4][CH:8]=[N:19]2)=[O:23])[C@@H:16]1[CH2:11][OH:22]
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:126075
chebi:126075
SSAZKPRPAYUHJV-LZLYRXPVSA-N
1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone