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1,2-dehydrogeissoschizoline

PropertiesImage
MNX_IDMNXM101189 Image of MNXM101189
referencechebi:65736
formulaC19H24N2O
global charge0
mol weight296.414
InChIKeyXJEKUKWZYMNSDW-XTXPVBGVSA-N
InChIInChI=1S/C19H24N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h3-6,12-14,17,22H,2,7-11H2,1H3/t12-,13+,14+,17+,19-/m1/s1
SMILESCC[C@@H]1CN2CC[C@]34C5=CC=CC=C5N=C3[C@@H](CO)[C@H]1C[C@H]24
MNX internals
InChI (mnx)InChI=1/C19H24N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h3-6,12-14,17,22H,2,7-11H2,1H3/t12-,13+,14+,17+,19-/m1/s1 Image of MNXM101189
SMILES (mnx)[CH3:1][CH2:2][C@@H:12]1[CH2:10][N:21]2[CH2:8][CH2:7][C@:19]34[C:15]5=[CH:5][CH:3]=[CH:4][CH:6]=[C:16]5[N:20]=[C:18]3[C@@H:14]([CH2:11][OH:22])[C@H:13]1[CH2:9][C@@H:17]42
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:65736
chebi:65736
XJEKUKWZYMNSDW-XTXPVBGVSA-N
1,2-dehydrogeissoschizoline
(15beta,16alpha)-1,2-didehydrocuran-17-ol