TPCN05346
Name | ??-D-Glucopyranoside, (3??,6??,12??)-3-[(6-O-??-D-glucopyranosyl-??-D-glucopyranosyl)oxy]-12,17-dihydroxy-6-(??-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-??-L-mannopyranosyl-(1??6)-O-[??-D-glucopyranosyl-(1??2)]- (9CI) |
Molecular Formula | C65H110O33 |
Molecular Weight | 1419.56 |
CAS Registry Number | 251101-59-4 |
SMILES | CC(C)=CCCC(C)(OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C1(O)CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(C)(C)C3C(OC3OCC(O)C(O)C3O)CC12C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Cucurbitaceae | Cyclanthera pedata | Fruits | 0.003100% | J Agric Food Chem. 1999. 47, 4512-4519. | 10.1021/jf9900128 |
Properties
HBA | 33 | HBD | 21 |
HeavyAtoms | 98 | AlogP | -6.80 |
TPSA | 535.59 | RotatableBonds | 20 |
FractionCSP3 | 0.97 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |