Summary
SMILES: COc1cc2CN3CCC4=C[C@@H]([C@H]([C@@H](c2cc1O)[C@H]34)O)OInChI: InChI=1S/C16H19NO4/c1-21-13-5-9-7-17-3-2-8-4-12(19)16(20)14(15(8)17)10(9)6-11(13)18/h4-6,12,14-16,18-20H,2-3,7H2,1H3/t12-,14-,15+,16+/m0/s1InChIKey: CKAHWDNDUGDSLE-ARLBYUKCSA-N
DeepSMILES: COcccCNCCC=C[C@@H][C@H][C@@H]c%11cc%15O))))[C@H]96))O))O
Scaffold Graph/Node/Bond level: C1=C2CCN3Cc4ccccc4C(CC1)C23
Scaffold Graph/Node level: C1CCC2C(C1)CN1CCC3CCCC2C31
Scaffold Graph level: C1CCC2C(C1)CC1CCC3CCCC2C31
Functional groups: CC(C)=CC; CN(C)C; CO; cO; 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: Lysine alkaloids|Tyrosine alkaloids
NP Classifier Class: Amarylidaceae alkaloids|Indolizidine alkaloids
Synonymous chemical names:pseudolycorinc, pseudolycorine, psi-lycorine
External chemical identifiers:CID:443689; ChEMBL:CHEMBL586091; ChEBI:32074; SureChEMBL:SCHEMBL20455707; MolPort-044-754-200
Chemical structure download