TPCN02746

Name Ouvrardiandines A
Molecular Formula C28H37NO7
Molecular Weight 499.60
CAS Registry Number 951765-87-0
SMILES C=C1C2CC3C(CC2=O)(C2CC4C5(C)CN(C)C(O2)C43CC(=O)C5OC(C)=O)C1OC(=O)C(C)CC
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum ouvrardianum Roots 0.000313% Chem Pharm Bull (Tokyo) 55, 1090-1092 (2007). 10.1248/cpb.55.1090
Properties
HBA 8 HBD 0
HeavyAtoms 36 AlogP 2.68
TPSA 99.21 RotatableBonds 4
FractionCSP3 0.79 Rings 8
AromaticRings 0 AliphaticRings 8