TPCN03873

Name Ilekudinchosides C
Molecular Formula C40H60O12
Molecular Weight 732.91
CAS Registry Number 1378931-10-2
SMILES CC1(C)C(OC2OC(CO)C(O)C2OC2OCC(O)C(O)C2O)CCC2(C)C1CCC1(C)C2C=CC2=C3C4(CCC(C)(OC4=O)C3(C)O)CCC21C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapindaceae Aesculus glabra Seeds 0.000420% Phytochemistry 75, 67-77 (2012). 10.1016/j.phytochem.2011.11.012
Properties
HBA 12 HBD 6
HeavyAtoms 52 AlogP 2.65
TPSA 184.60 RotatableBonds 5
FractionCSP3 0.88 Rings 9
AromaticRings 0 AliphaticRings 9