TPCN05661

Name Ilexoside XXVII;TPG4
Molecular Formula C41H66O14
Molecular Weight 782.97
CAS Registry Number 147235-21-0
SMILES CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Rosenbergiodendron formosum Leaves 0.143214% Phytochemistry. 2000 May;54(1):77-84. 10.1016/s0031-9422(00)00034-0.
Araliaceae Trevesia palmata Aerial parts 0.005577% Sci Rep . 2018 Sep 28;8(1):14522 10.1038/s41598-018-32956-4
Properties
HBA 14 HBD 9
HeavyAtoms 55 AlogP 0.90
TPSA 236.06 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7