Summary
SMILES: O=CN1c2ccccc2C(=O)N2[C@H]1c1[nH]c3c(c1CC2)cccc3InChI: InChI=1S/C19H15N3O2/c23-11-22-16-8-4-2-6-14(16)19(24)21-10-9-13-12-5-1-3-7-15(12)20-17(13)18(21)22/h1-8,11,18,20H,9-10H2/t18-/m1/s1InChIKey: JUVKOVVIBPSXTO-GOSISDBHSA-N
DeepSMILES: O=CNcccccc6C=O)N[C@H]%10c[nH]ccc5CC9)))cccc6
Scaffold Graph/Node/Bond level: O=C1c2ccccc2NC2c3[nH]c4ccccc4c3CCN12
Scaffold Graph/Node level: OC1C2CCCCC2NC2C3NC4CCCCC4C3CCN12
Scaffold Graph level: CC1C2CCCCC2CC2C1CCC1C3CCCCC3CC12
Functional groups: c[C@H]1N(C=O)ccC(=O)N1C; c[nH]c
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Organoheterocyclic compoundsClassyFire Class: Indoles and derivatives
ClassyFire Subclass: Pyridoindoles
NP Classifier Biosynthetic pathway: Alkaloids
NP Classifier Superclass: Tryptophan alkaloids
NP Classifier Class: Carboline alkaloids
Synonymous chemical names:14-formyldihydrorutaecarpine
External chemical identifiers:CID:5317369; ZINC:ZINC000013480260
Chemical structure download