TPCN05394

Name 19-Norlanost-5-en-11-one, 25-(acetyloxy)-3-(??-D-glucopyranosyloxy)-16,20,22-trihydroxy-9-methyl-, (3??,9??,10??,16??)- (9CI)
Molecular Formula C38H62O12
Molecular Weight 710.90
CAS Registry Number 178062-95-8
SMILES CC(=O)OC(C)(C)CCC(O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CCC(OC5OC(CO)C(O)C(O)C5O)C4(C)C)C3(C)C(=O)CC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Cyclanthera pedata Fruits 0.001600% J Agric Food Chem. 1999. 47, 4512-4519. 10.1021/jf9900128
Properties
HBA 12 HBD 7
HeavyAtoms 50 AlogP 2.16
TPSA 203.44 RotatableBonds 9
FractionCSP3 0.89 Rings 5
AromaticRings 0 AliphaticRings 5