TPCN05364
Name | 19-Norlanost-5-en-11-one, 3-[(O-6-deoxy-??-L-mannopyranosyl-(1??4)-O-[??-D-glucopyranosyl-(1??6)]-??-D-glucopyranosyl)oxy]-16,20,22,25-tetrahydroxy-9-methyl-, (3??,9??,10??,16??)- (9CI) |
Molecular Formula | C48H80O20 |
Molecular Weight | 977.15 |
CAS Registry Number | 251102-63-3 |
SMILES | CC1OC(OC2C(COC3OC(CO)C(O)C(O)C3O)OC(OC3CCC4C(=CCC5C4(C)C(=O)CC4(C)C(C(C)(O)C(O)CCC(C)(C)O)C(O)CC54C)C3(C)C)C(O)C2O)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Cucurbitaceae | Cyclanthera pedata | Fruits | 0.002400% | J Agric Food Chem. 1999. 47, 4512-4519. | 10.1021/jf9900128 |
Properties
HBA | 20 | HBD | 13 |
HeavyAtoms | 68 | AlogP | -1.73 |
TPSA | 335.44 | RotatableBonds | 13 |
FractionCSP3 | 0.94 | Rings | 7 |
AromaticRings | 0 | AliphaticRings | 7 |