TPCN03315

Name 7,12-O-diacetyl3-O-(2-methylbutanoyl)-8-O-methylingol
Molecular Formula C30H44O9
Molecular Weight 548.67
CAS Registry Number 928298-78-6
SMILES CCC(C)C(=O)OC1C(C)CC23OC12C=C(C)C(OC(C)=O)C(OC)C1C(C(OC(C)=O)C(C)C3=O)C1(C)C
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Euphorbiaceae Euphorbia cornigera Roots 0.000260% Planta Med 2006; 72: 830±834 10.1055/s-2006-946683
Properties
HBA 9 HBD 0
HeavyAtoms 39 AlogP 3.81
TPSA 117.73 RotatableBonds 6
FractionCSP3 0.80 Rings 4
AromaticRings 0 AliphaticRings 4