Summary
SMILES: COc1cc2CCN3[C@H](c2cc1O)Cc1c(C3)c2OCOc2cc1InChI: InChI=1S/C19H19NO4/c1-22-18-7-12-4-5-20-9-14-11(2-3-17-19(14)24-10-23-17)6-15(20)13(12)8-16(18)21/h2-3,7-8,15,21H,4-6,9-10H2,1H3/t15-/m0/s1InChIKey: FVXCQULKSPVRPK-HNNXBMFYSA-N
DeepSMILES: COcccCCN[C@H]c6cc%10O))))CccC6)cOCOc5cc9
Scaffold Graph/Node/Bond level: c1ccc2c(c1)CCN1Cc3c(ccc4c3OCO4)CC21
Scaffold Graph/Node level: C1CCC2C(C1)CCN1CC3C(CCC4OCOC43)CC21
Scaffold Graph level: C1CCC2C(C1)CCC1CC3C(CCC4CCCC43)CC12
Functional groups: CN(C)C; c1cOCO1; cO; cOC
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Alkaloids and derivativesClassyFire Class: Protoberberine alkaloids and derivatives
NP Classifier Biosynthetic pathway: Alkaloids
NP Classifier Superclass: Tyrosine alkaloids
NP Classifier Class: Isoquinoline alkaloids|Protoberberine alkaloids
Synonymous chemical names:(-) cheilanthifoline, cheilanthifoline
External chemical identifiers:CID:440582; ChEBI:16233; ZINC:ZINC000030725564; SureChEMBL:SCHEMBL18890976
Chemical structure download