Account Calcium (S)-2-benzyl-4-((3aR,7aS)-octahydro-2H-isoindol-2-yl)-4-oxobutanoate dihydrate
- Catalog No. :
- ACUNMB950
- CAS No. :
- 207844-01-7
- Molecular Formula :
- C38H52CaN2O8
- Molecular Weight :
- 704.92
IUPAC Name:calcium (S)-2-benzyl-4-((3aR,7aS)-octahydro-2H-isoindol-2-yl)-4-oxobutanoate dihydrate
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Product Information
| Product Name | Calcium (S)-2-benzyl-4-((3aR,7aS)-octahydro-2H-isoindol-2-yl)-4-oxobutanoate dihydrate |
|---|---|
| IUPAC Name | calcium (S)-2-benzyl-4-((3aR,7aS)-octahydro-2H-isoindol-2-yl)-4-oxobutanoate dihydrate |
| MDL No. | MFCD08460208 |
| Molecular Formula | C38H52CaN2O8 |
| Molecular Weight | 704.92 |
| SMILES | O=C(C[C@H](CC1=CC=CC=C1)C(O[Ca]OC([C@@H](CC2=CC=CC=C2)CC(N3C[C@@]4([H])CCCC[C@@]4([H])C3)=O)=O)=O)N5C[C@]6([H])CCCC[C@]6([H])C5.O.O |
| InChI Key | QEVLNUAVAONTEW-UZYHXJQGSA-L |
| Synonym | S-21403 calcium hydrate | Mitiglinide calcium dihydrate | Tox21_112571 | calcium;(2S)-4-[(3aR,7aS)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-benzyl-4-oxobutanoate;dihydrate | Mitiglinide calcium dihydrate [WHO-DD] | MLS000522028 | Z2859091834 | 5-nitro- |
| CAS No. | 207844-01-7 |
| PubChem CID | 6918235 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
