TPCN00507

Name 19(E)-9,18-didemethoxygardneramine
Molecular Formula C21H24N2O3
Molecular Weight 352.43
CAS Registry Number 1287228-45-8
SMILES CC=C1CN2C3CC45C(=Nc6c(OC)cc(OC)cc64)OCC3C1CC25
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Loganiaceae Gardneria ovata Aerial parts 0.000186% J Nat Prod, 2011, 74, 1073-1078. 10.1021/np2000254
Properties
HBA 5 HBD 0
HeavyAtoms 26 AlogP 3.05
TPSA 43.29 RotatableBonds 2
FractionCSP3 0.57 Rings 7
AromaticRings 1 AliphaticRings 6