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