Primary Record
CHEMBL5805818
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 118435750
- SMILES
- CCOC(=O)C1CS(=O)(=O)CCN1CCN[C@]23CC[C@H]([C@@H]2[C@H]4CC[C@H]5[C@]([C@@]4(CC3)C)(CC[C@@H]6[C@@]5(CC=C(C6(C)C)C7=CC[C@@](CC7)(CF)C(=O)O)C)C)C(=C)C
- Canonical SMILES
- C=C(C)[C@@H]1CC[C@]2(NCCN3CCS(=O)(=O)CC3C(=O)OCC)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(C(=O)O)CC6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
Names & Synonyms
- CHEMBL5805818
- SCHEMBL17162614
- BDBM372358
- US10245275, Example 14
- US10245275, Example 15
- (1R)-4-[(1R,3aS,5aR,5bR,7aR,11aS,11bR,13aR,13bR)-3a-[2-(3-ethoxycarbonyl-1,1-dioxo-1,4-thiazinan-4-yl)ethylamino]-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,11,11b,12,13,13a,13b-tetradecahydrocyclopenta[a]chrysen-9-yl]-1-(fluoromethyl)cyclohex-3-ene-1-carboxylic acid
- Preparation of (1R)-4-((1R,3aS,5aR,5bR,7aR,7aR,11aS,11bR,13aR,13bR)-3a-((2-(3-(ethoxycarbonyl)-1,1-dioxidothiomorpholino)ethyl)amino)-5a,5b, 8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-2,3,3a,4,5,5a,5b,6,7,7a,8,11,11a,11 b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-yl)-1-(fluoromethyl)cyclohex-3-enecarboxylic acid