Summary
SMILES: CO[C@@H]1C=C[C@]23[C@H](C1)N(CC2)Cc1c3cc(OC)c(c1)OCInChI: InChI=1S/C18H23NO3/c1-20-13-4-5-18-6-7-19(17(18)9-13)11-12-8-15(21-2)16(22-3)10-14(12)18/h4-5,8,10,13,17H,6-7,9,11H2,1-3H3/t13-,17+,18+/m1/s1InChIKey: WFMPBYKDVOTCEI-BVGQSLNGSA-N
DeepSMILES: CO[C@@H]C=C[C@][C@H]C6)NCC5))Ccc6ccOC))cc6)OC
Scaffold Graph/Node/Bond level: C1=CC23CCN(Cc4ccccc42)C3CC1
Scaffold Graph/Node level: C1CCC2C(C1)CN1CCC23CCCCC13
Scaffold Graph level: C1CCC2C(C1)CC1CCC23CCCCC13
Functional groups: CC=CC; CN(C)C; COC; cOC
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Organoheterocyclic compoundsClassyFire Class: Quinolines and derivatives
ClassyFire Subclass: Benzoquinolines
NP Classifier Biosynthetic pathway: Alkaloids
NP Classifier Superclass: Tyrosine alkaloids
NP Classifier Class: Amarylidaceae alkaloids|Isoquinoline alkaloids
Synonymous chemical names:o-methylmaritidine
External chemical identifiers:CID:101711019; ZINC:ZINC000014587205
Chemical structure download