TPCN02070

Name Triptersinoids A
Molecular Formula C28H36O11
Molecular Weight 548.59
CAS Registry Number 2579127-92-5
SMILES CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)CC(C)(O)C13CC(C(O)C2OC(=O)c1ccccc1)C(C)(C)O3
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 11 HBD 2
HeavyAtoms 39 AlogP 1.71
TPSA 154.89 RotatableBonds 6
FractionCSP3 0.64 Rings 4
AromaticRings 1 AliphaticRings 3