Summary
SMILES: C[C@@H]1C[C@H]2CC(=O)[C@@H]3[C@]42[C@](C1)(O)N(CCC3)CCC4InChI: InChI=1S/C16H25NO2/c1-11-8-12-9-14(18)13-4-2-6-17-7-3-5-15(12,13)16(17,19)10-11/h11-13,19H,2-10H2,1H3/t11-,12+,13-,15+,16+/m1/s1InChIKey: ZLMYGBDFISIGLH-WALBABNVSA-N
DeepSMILES: C[C@@H]C[C@H]CC=O)[C@@H][C@@]5[C@]C9)O)NCCC7)))CCC6
Scaffold Graph/Node/Bond level: O=C1CC2CCCC3N4CCCC1C23CCC4
Scaffold Graph/Node level: OC1CC2CCCC3N4CCCC1C23CCC4
Scaffold Graph level: CC1CC2CCCC3C4CCCC1C23CCC4
Functional groups: CC(C)=O; CN(C)[C@](C)(C)O
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: Organoheterocyclic compoundsClassyFire Class: Azaspirodecane derivatives
NP Classifier Biosynthetic pathway: Alkaloids
NP Classifier Superclass: Lysine alkaloids
NP Classifier Class: Quinolizidine alkaloids
Synonymous chemical names:fawcettimine, netural-fawcettimine
External chemical identifiers:CID:442475; ChEBI:4989; SureChEMBL:SCHEMBL14554631
Chemical structure download