TPCN05742

Name 19-Norlanosta-1,5,23-triene-3,11,22-trione, 2-(??-D-glucopyranosyloxy)-20,25-dihydroxy-9-methyl-16-(1-methylethenyl)-, (9??,10??,16??,23E)- (ACI)
Molecular Formula C39H56O11
Molecular Weight 700.87
CAS Registry Number 1910091-23-4
SMILES C=C(C)C1CC2(C)C3CC=C4C(C=C(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C)C3(C)C(=O)CC2(C)C1C(C)(O)C(=O)C=CC(C)(C)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Citrullus colocynthis Fruits 0.001342% J Asian Nat Prod Res. 2015;17(8):813-8. 10.1080/10286020.2015.1015999.
Properties
HBA 11 HBD 6
HeavyAtoms 50 AlogP 2.71
TPSA 191.05 RotatableBonds 8
FractionCSP3 0.72 Rings 5
AromaticRings 0 AliphaticRings 5