TPCN03121

Name Tanguticulina B
Molecular Formula C25H35NO5
Molecular Weight 429.56
CAS Registry Number 2353515-75-8
SMILES C=C1CC23CC4C5C6(C)CC(OC(=O)C(C)CC)CC57C(C2C(O)C1C(O)C37O)N4C6
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum tanguticum Whole plants 0.000056% Phytochemistry 160, 71-77 (2019). 10.1016/j.phytochem.2018.11.008
Properties
HBA 6 HBD 3
HeavyAtoms 31 AlogP 1.48
TPSA 90.23 RotatableBonds 3
FractionCSP3 0.88 Rings 9
AromaticRings 0 AliphaticRings 9