TPCN03563

Name Madlongisides D
Molecular Formula C41H66O14
Molecular Weight 782.97
CAS Registry Number 58019-21-9
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(O)C(C)(CO)C6C(O)CC5(C)C3(C)CC4)OCC(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Fabaceae Derris eriocarpa Stems 0.002500% J Agric Food Chem 65, 2357-2363 (2017). 10.1021/acs.jafc.7b00137
Properties
HBA 14 HBD 9
HeavyAtoms 55 AlogP 0.90
TPSA 236.06 RotatableBonds 5
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7