TPCN05348
Name | ??-D-Glucopyranoside, (3??,6??,12??)-3,12,17-trihydroxy-6-(??-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-??-L-mannopyranosyl-(1??6)-O-[??-D-glucopyranosyl-(1??2)]- (9CI) |
Molecular Formula | C53H90O23 |
Molecular Weight | 1095.28 |
CAS Registry Number | 251101-56-1 |
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(O)C(C)(C)C3C(OC3OCC(O)C(O)C3O)CC12C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Cucurbitaceae | Cyclanthera pedata | Fruits | 0.003000% | J Agric Food Chem. 1999. 47, 4512-4519. | 10.1021/jf9900128 |
Properties
HBA | 23 | HBD | 15 |
HeavyAtoms | 76 | AlogP | -2.45 |
TPSA | 377.29 | RotatableBonds | 14 |
FractionCSP3 | 0.96 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |