TPCN06230

Name Xuedanoside E
Molecular Formula C36H56O11
Molecular Weight 664.83
CAS Registry Number 2525095-58-1
SMILES CC(=CC1CC(C)(O)C2C(CC3(C)C4CC=C5C(CC(O)C(OC6OC(CO)C(O)C(O)C6O)C5(C)C)C4(C)C(=O)CC23C)O1)CO
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Hemsleya amabilis Subterraneous stems 0.000162% Fitoterapia . 2019 Nov;139:104404 10.1016/j.fitote.2019.104404
Properties
HBA 11 HBD 7
HeavyAtoms 47 AlogP 1.38
TPSA 186.37 RotatableBonds 5
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6