TPCN00717

Name Humantenoxenine
Molecular Formula C21H24N2O4
Molecular Weight 368.43
CAS Registry Number 1268466-95-0
SMILES CON1C(=O)C2(CC3C4COC2CC4C(C(C)=O)=CN3C)c2ccccc21
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Gelsemiaceae Gelsemium elegans Roots 0.000037% Chem Asian J, 2011, 6, 166-173. 10.1002/asia.201000538
Properties
HBA 6 HBD 0
HeavyAtoms 27 AlogP 2.04
TPSA 59.08 RotatableBonds 2
FractionCSP3 0.52 Rings 6
AromaticRings 1 AliphaticRings 5