Account Ammonium (3R,5R)-7-((1S,2S,6R,8S,8aR)-8-((2,2-dimethylbutanoyl)oxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3,5-dihydroxyheptanoate
- Catalog No. :
- ACJIDL475
- CAS No. :
- 139893-43-9
- Molecular Formula :
- C25H43NO6
- Molecular Weight :
- 453.62
IUPAC Name:-
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Product Information
| Product Name | Ammonium (3R,5R)-7-((1S,2S,6R,8S,8aR)-8-((2,2-dimethylbutanoyl)oxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3,5-dihydroxyheptanoate |
|---|---|
| MDL No. | MFCD07773041 |
| Molecular Formula | C25H43NO6 |
| Molecular Weight | 453.62 |
| SMILES | O=C([O-])C[C@H](O)C[C@H](O)CC[C@H]1[C@@H](C)C=CC2=C[C@H](C)C[C@H](OC(C(C)(C)CC)=O)[C@]12[H].[NH4+] |
| InChI Key | FFPDWNBTEIXJJF-OKDJMAGBSA-N |
| Synonym | Simvastatin acid (ammonium) | Tenivastatin ammonium salt | Simvastatin ammonium salt | 1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-beta,delta-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (betaR,deltaR,1S,2S,6R,8S,8aR) |
| CAS No. | 139893-43-9 |
| PubChem CID | 12967766 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H351-H360-H412
- Precautionary Statement(s)
- P201-P273-P281-P308+P313
Synthetic Route by SureRoute
2. ACJIDL475 Molecular Building Block Synthetic Route
Sodium (3R,5R)-7-((1S,2S,6R,8S,8aR)-8-((2,2-dimethylbutanoyl)oxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3,5-dihydroxyheptanoate
(3R,5R)-7-((1S,2S,6R,8S,8aR)-8-((2,2-dimethylbutanoyl)oxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3,5-dihydroxyheptanoic acid
calcium (3R,5R)-7-((1S,2S,6R,8S,8aR)-8-((2,2-dimethylbutanoyl)oxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3,5-dihydroxyheptanoate