TPCN00413

Name Gelseganines C
Molecular Formula C29H34N2O4
Molecular Weight 474.60
CAS Registry Number 1095492-43-5
SMILES C=CC12CN(CC3C(=O)OC4CC(C)C(CO)C43)C3CC14C(=Nc1ccccc14)C1CC2C3CO1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Loganiaceae Gelsemium elegans Aerial parts 0.000333% Chem Asian J, 2008, 3, 1824-1829. 10.1002/asia.200800021
Properties
HBA 6 HBD 1
HeavyAtoms 35 AlogP 3.11
TPSA 71.36 RotatableBonds 4
FractionCSP3 0.66 Rings 9
AromaticRings 1 AliphaticRings 8