TPCN02069

Name Triptersinoids C
Molecular Formula C32H35NO12
Molecular Weight 625.63
CAS Registry Number 2579128-34-8
SMILES CC(=O)OCC12C(OC(=O)c3ccccc3)C(=O)C3C(O)C1(OC3(C)C)C(C)C(OC(=O)c1cccnc1)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 13 HBD 2
HeavyAtoms 45 AlogP 1.43
TPSA 184.85 RotatableBonds 7
FractionCSP3 0.50 Rings 5
AromaticRings 2 AliphaticRings 3