TPCN02660

Name Weisaconitine B
Molecular Formula C22H35NO5
Molecular Weight 393.52
CAS Registry Number 1616118-33-2
SMILES CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2CC4(O)C1C2O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum weixiense Roots 0.000433% Fitoterapia 91, 280-283 (2013). 10.1016/j.fitote.2013.09.013
Properties
HBA 6 HBD 3
HeavyAtoms 28 AlogP 0.63
TPSA 82.39 RotatableBonds 3
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6