TPCN03010

Name Kiridine
Molecular Formula C22H31NO6
Molecular Weight 405.49
CAS Registry Number 161068-73-1
SMILES CCN1CC23OC2CC(O)C24C1C(CC32)C12CC(OC)C3CC4C1(OCO2)C3O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum kirinense Whole plants 0.000105% Fitoterapia 141, 104477 (2020). 10.1016/j.fitote.2020.104477
Properties
HBA 7 HBD 2
HeavyAtoms 29 AlogP 0.13
TPSA 83.92 RotatableBonds 2
FractionCSP3 1.00 Rings 8
AromaticRings 0 AliphaticRings 8