Search MNXref
 Feedback

(19E)-geissoschizine

MNXM3026 is deprecated and here replaced by MNXM733705
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM733705 Image of MNXM733705
referencechebi:17037
formulaC21H24N2O3
global charge0
mol weight352.434
InChIKeyWKWHYFHGTWZCLM-KGZWXYIYSA-N
InChIInChI=1S/C21H24N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,12,16,19,22,24H,8-11H2,1-2H3/b13-3-,17-12-/t16-,19-/m0/s1
SMILESC/C=C1/CN2CCC3=C(NC4=CC=CC=C43)[C@@H]2C[C@@H]1/C(=C/O)C(=O)OC
MNX internals
InChI (mnx)InChI=1/C21H24N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,12,16,19,22,24H,8-11H2,1-2H3/b13-3-,17-12-/t16-,19-/m0/s1 Image of MNXM733705
SMILES (mnx)[CH3:1]/[CH:3]=[C:13]1/[CH2:11][N:23]2[CH2:9][CH2:8][C:15]3=[C:20]([C@@H:19]2[CH2:10][C@@H:16]1/[C:17](=[CH:12]/[OH:24])[C:21](=[O:25])[O:26][CH3:2])[NH:22][C:18]1=[CH:7][CH:5]=[CH:4][CH:6]=[C:14]31
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:17037
chebi:17037
WKWHYFHGTWZCLM-KGZWXYIYSA-N 		(19E)-geissoschizine
(+)-geissoschizine
(16Z,19E)-17-hydroxy-16-methoxycarbonyl-16,19-didehydro-corynane
19E-geissoschizine
Corynan-16-carboxylic acid, 16,17,19,20-tetradehydro-17-hydroxy-, methyl ester, (16Z,19E)-
geissoschizine
methyl (16Z,19E)-17-hydroxycoryna-16,19-dien-16-carboxylate

metacyc.compound:GEISSOSCHIZINE
metacycM:GEISSOSCHIZINE
WKWHYFHGTWZCLM-KGZWXYIYSA-N 		19E-geissoschizine

chebi:14292
chebi:24201
chebi:5282 		secondary/obsolete/fantasy identifier