TPCN03468

Name Euphornan J
Molecular Formula C40H44O12
Molecular Weight 716.78
CAS Registry Number 2685765-76-6
SMILES CC(=O)OC1C(C)=CC23OC2(CC(C)C3OC(C)=O)C(=O)C(C)C(OC(C)=O)C2C(C1OC(=O)c1ccccc1)C2(C)COC(=O)c1ccccc1
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Euphorbia marginata Seeds 0.000667% None 10.1016/j.bioorg.2019.103546
Properties
HBA 12 HBD 0
HeavyAtoms 52 AlogP 4.83
TPSA 161.10 RotatableBonds 8
FractionCSP3 0.50 Rings 6
AromaticRings 2 AliphaticRings 4