TPCN02068

Name Triptregeline F
Molecular Formula C32H37NO11
Molecular Weight 611.64
CAS Registry Number 2197992-89-3
SMILES CC(=O)OCC12C(OC(C)=O)CCC(C)(O)C13OC(C)(C)C(C(OC(=O)c1cccnc1)C2OC(=O)c1ccccc1)C3O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Tripterygium regelii Stems 0.000007% Fitoterapia 112: 1-8.(2016) 10.1016/j.fitote.2016.04.016
Properties
HBA 12 HBD 2
HeavyAtoms 44 AlogP 2.40
TPSA 167.78 RotatableBonds 7
FractionCSP3 0.53 Rings 5
AromaticRings 2 AliphaticRings 3