TPCN02067

Name Triptersinoids E
Molecular Formula C28H34O10
Molecular Weight 530.57
CAS Registry Number 2579128-66-6
SMILES CC(=O)OCC12C(OC(=O)c3ccccc3)C(=O)C3CC1(OC3(C)C)C(C)CC(OC(C)=O)C2OC(C)=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Tripterygium wilfordii Leaves 0.000007% Bioorg Chem 92: 103288.(2019) 10.1016/j.bioorg.2019.103288
Properties
HBA 10 HBD 0
HeavyAtoms 38 AlogP 2.80
TPSA 131.50 RotatableBonds 6
FractionCSP3 0.61 Rings 4
AromaticRings 1 AliphaticRings 3