TPCN00656

Name 15-hydroxyhumantenoxenine
Molecular Formula C21H24N2O5
Molecular Weight 384.43
CAS Registry Number 1268466-96-1
SMILES CON1C(=O)C2(CC3C4COC2CC4(O)C(C(C)=O)=CN3C)c2ccccc21
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Gelsemiaceae Gelsemium elegans Roots 0.000067% Chem Asian J, 2011, 6, 166-173. 10.1002/asia.201000538
Properties
HBA 7 HBD 1
HeavyAtoms 28 AlogP 1.16
TPSA 79.31 RotatableBonds 2
FractionCSP3 0.52 Rings 6
AromaticRings 1 AliphaticRings 5