TPCN02944

Name Yuanhuadine
Molecular Formula C32H42O10
Molecular Weight 586.68
CAS Registry Number 76402-66-9
SMILES C=C(C)C12OC3(C=CC=CCCCCC)OC1C1C4OC4(CO)C(O)C4(O)C(=O)C(C)=CC4C1(O3)C(C)C2OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Thymelaeaceae Daphne genkwa Buds 0.000151% Nat Prod Res 29, 1878-1883 (2015). 10.1080/14786419.2015.1009459
Properties
HBA 10 HBD 3
HeavyAtoms 42 AlogP 2.41
TPSA 144.28 RotatableBonds 9
FractionCSP3 0.69 Rings 6
AromaticRings 0 AliphaticRings 6