Account 3-(((7R,8R,9S,13S,14S,17S)-3,17-Dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid
- Catalog No. :
- ACZJME324
- CAS No. :
- 53212-83-2
- Molecular Formula :
- C21H28O4S
- Molecular Weight :
- 376.52
IUPAC Name:3-(((7S,8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid
![3-(((7R,8R,9S,13S,14S,17S)-3,17-Dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-(((7R,8R,9S,13S,14S,17S)-3,17-Dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid |
|---|---|
| IUPAC Name | 3-(((7S,8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid |
| Molecular Formula | C21H28O4S |
| Molecular Weight | 376.52 |
| SMILES | C[C@]12CC[C@@H]3C4=CC=C(O)C=C4CC(SCCC(=O)O)[C@H]3[C@@H]1CC[C@@H]2O |
| InChI Key | LOOXNDFQKVZPJO-KVIMDYBWSA-N |
| Synonym | 3-(((8R,9S,13S,14S,17S)-3,17-dihydroxy-13-Methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid;Propanoic acid, 3-[[(7α,17β)-3,17-dihydroxyestra-1,3,5(10)-trien-7-yl]thio]- (9CI);3-(((7R,8R,9S,13S,14S,17S)-3,17-Dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-7-yl)thio)propanoic acid |
| CAS No. | 53212-83-2 |
Synthetic Route by SureRoute
2. ACZJME324 Molecular Building Block Synthetic Route
E-982
(8R,9S,13S,14S,17S)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-2,3,17-triol
(7R,8R,9S,13S,14S,17S)-7-(9-Bromononyl)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol