TPCN03041

Name Bullatine H
Molecular Formula C23H35NO6
Molecular Weight 421.53
CAS Registry Number 2185868-87-3
SMILES CC(=O)OC1CC23C4CC5C6(C)CCCC5(C4N(C)C6)C2C(O)C1C(O)(CO)C3O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum brachypodum Roots 0.000092% J Asian Nat Prod Res 18, 908-912 (2016). 10.1080/10286020.2016.1173677
Properties
HBA 7 HBD 4
HeavyAtoms 30 AlogP 0.14
TPSA 110.46 RotatableBonds 2
FractionCSP3 0.96 Rings 7
AromaticRings 0 AliphaticRings 7