TPCN01929

Name Davidianones B
Molecular Formula C16H12O5
Molecular Weight 284.27
CAS Registry Number 181301-43-9
SMILES COC(=O)c1ccc2c3c1C(=O)C(=O)C(C)=C3OC=C2C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Ulmus davidiana Barks 0.000048% Phytochemistry 43(2): 425-430.(1996) 10.1016/0031-9422(96)00279-8
Properties
HBA 5 HBD 0
HeavyAtoms 21 AlogP 2.36
TPSA 69.67 RotatableBonds 1
FractionCSP3 0.19 Rings 3
AromaticRings 1 AliphaticRings 2