TPCN02773

Name Ouvrardiandines B
Molecular Formula C30H33NO7
Molecular Weight 519.59
CAS Registry Number 951765-88-1
SMILES C=C1C2CC3C(CC2=O)(C2CC4C5(C)CN(C)C(O2)C43CC(=O)C5OC(C)=O)C1OC(=O)c1ccccc1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum ouvrardianum Aerial parts 0.000281% Chem Pharm Bull (Tokyo) 55, 1090-1092 (2007). 10.1248/cpb.55.1090
Properties
HBA 8 HBD 0
HeavyAtoms 38 AlogP 2.95
TPSA 99.21 RotatableBonds 3
FractionCSP3 0.60 Rings 9
AromaticRings 1 AliphaticRings 8