Account sodium (4R)-4-((3R,5S,7S,10S,13R,17R)-10,13-dimethyl-3,7-bis(sulfonatooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate
- Catalog No. :
- ACPUUY730
- CAS No. :
- 89232-83-7
- Molecular Formula :
- C24H37Na3O10S2
- Molecular Weight :
- 618.65
IUPAC Name:sodium (4R)-4-((3R,5S,7S,10S,13R,17R)-10,13-dimethyl-3,7-bis(sulfonatooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate
![sodium (4R)-4-((3R,5S,7S,10S,13R,17R)-10,13-dimethyl-3,7-bis(sulfonatooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | sodium (4R)-4-((3R,5S,7S,10S,13R,17R)-10,13-dimethyl-3,7-bis(sulfonatooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate |
|---|---|
| IUPAC Name | sodium (4R)-4-((3R,5S,7S,10S,13R,17R)-10,13-dimethyl-3,7-bis(sulfonatooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate |
| MDL No. | MFCD01732068 |
| Molecular Formula | C24H37Na3O10S2 |
| Molecular Weight | 618.65 |
| SMILES | C[C@H](CCC(=O)[O-])[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC[C@@H](OS(=O)(=O)[O-])C[C@H]1C[C@@H]3OS(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChI Key | GRNVFQGDTHVNHO-DBQNOVHGSA-K |
| Synonym | ursodeoxycholate-3-sulfate;Ursulcholic acid trisodiuM salt |
| CAS No. | 89232-83-7 |
Synthetic Route by SureRoute
2. ACPUUY730 Molecular Building Block Synthetic Route
(R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(sulfooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
(R)-4-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-7-(sulfooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
sodium (3R,5R,7R,8R,9S,10S,13R,14S,17R)-17-((R)-6-fluoro-5-oxohexan-2-yl)-7-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-3-yl sulfate