Ingredients

(1r,2r,5r,6s)-2-[(8s,9s,10r,13s,14s,17r)-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-6-(methoxymethyl)-5-methyl-4,8-dioxabicyclo[3.3.1]nonan-7-one

C29H40O5

Basic Information

Grouped by core information, identifiers, and descriptions.

Name: (1r,2r,5r,6s)-2-[(8s,9s,10r,13s,14s,17r)-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-6-(methoxymethyl)-5-methyl-4,8-dioxabicyclo[3.3.1]nonan-7-one
Molecular Formula: C29H40O5
Molecular Weight: No data
Canonical SMILES: CC12CCC3C(C1CCC2C4COC5(CC4OC(=O)C5COC)C)CC=C6C3(C(=O)C=CC6)C
Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2[C@@H]4CO[C@@]5(C[C@H]4OC(=O)[C@H]5COC)C)CC=C6[C@@]3(C(=O)C=CC6)C
InChI: InChI=1S/C29H40O5/c1-27-13-12-22-18(9-8-17-6-5-7-25(30)29(17,22)3)20(27)10-11-21(27)19-15-33-28(2)14-24(19)34-26(31)23(28)16-32-4/h5,7-8,18-24H,6,9-16H2,1-4H3/t18-,19-,20-,21+,22-,23+,24+,27-,28+,29-/m0/s1
Oral Bioavailability: 81.261
Drug Likeness: 0.436
DL Score: No data
Caco-2 Permeability: No data
ALogP: No data
Bioavailability Score: No data