Summary
SMILES: CO[C@@]12C[C@H]3C4=CCO[C@@H]5[C@H]3[C@H]3[C@]2(CCN1C4)c1ccccc1N3C(=O)C5InChI: InChI=1S/C22H24N2O3/c1-26-22-11-14-13-6-9-27-17-10-18(25)24-16-5-3-2-4-15(16)21(22,20(24)19(14)17)7-8-23(22)12-13/h2-6,14,17,19-20H,7-12H2,1H3/t14-,17-,19-,20-,21-,22+/m0/s1InChIKey: BMDMNLBIKSAWCI-FCGMOTLLSA-N
DeepSMILES: CO[C@]C[C@H]C=CCO[C@@H][C@H]7[C@H][C@]%11CCN%14C%12))))cccccc6N9C=O)C%13
Scaffold Graph/Node/Bond level: O=C1CC2OCC=C3CN4CCC56c7ccccc7N1C5C2C3CC46
Scaffold Graph/Node level: OC1CC2OCCC3CN4CCC56C7CCCCC7N1C5C2C3CC46
Scaffold Graph level: CC1CC2CCCC3CC4CCC56C4CC3C2C5C1C1CCCCC16
Functional groups: CC=C(C)C; COC; CO[C@](C)(C)N(C)C; cN(C)C(C)=O
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Alkaloids and derivativesClassyFire Class: Strychnos alkaloids
NP Classifier Biosynthetic pathway: Alkaloids
NP Classifier Superclass: Tryptophan alkaloids
NP Classifier Class: Aspidosperma-Iboga hybrid type (Vinca alkaloids)|Strychnos type
Synonymous chemical names:methoxystrychinine
External chemical identifiers:CID:21723445; ZINC:ZINC000095876291
Chemical structure download