Ingredients

16-acetylgitoxigenin

C25H36O6

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: 16-acetylgitoxigenin
Molecular Formula: C25H36O6
Molecular Weight: No data
Canonical SMILES: CC(=O)OC1CC2(C3CCC4CC(CCC4(C3CCC2(C1C5=CC(=O)OC5)C)C)O)O
Isomeric SMILES: CC(=O)O[C@H]1C[C@@]2([C@@H]3CC[C@@H]4C[C@H](CC[C@@]4([C@H]3CC[C@@]2([C@H]1C5=CC(=O)OC5)C)C)O)O
InChI: InChI=1S/C25H36O6/c1-14(26)31-20-12-25(29)19-5-4-16-11-17(27)6-8-23(16,2)18(19)7-9-24(25,3)22(20)15-10-21(28)30-13-15/h10,16-20,22,27,29H,4-9,11-13H2,1-3H3/t16-,17+,18+,19-,20+,22+,23+,24-,25+/m1/s1
Oral Bioavailability: No data
Drug Likeness: 0.651
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data