Products 126860-83-1
CAS 126860-83-1 appears in our catalog under these names: MC 1046, Calcipotriol EP Impurity A, (1Alpha,3Beta,5Z,7E,22E)-24-Cyclopropyl-1,3-dihydroxy-9,10-Secochola-5,7,10(19),22-tetraen-24-one (90%), MC 1046, 94.29%, MC 1046, 95%. Offered by: GLPBio, Chemat Brand, TRC, MedChemExpress, Fluorochem. Available pack sizes: 1mg, on request, 2,5mg, 1 mg, 500 μg.
(E,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-one (CAS 126860-83-1) is a chemical compound with the molecular formula C27H38O3 and a molecular weight of 410.6 g/mol. IUPAC name: (E,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-one. InChIKey: KKDBQSPKXAUHPH-NRCQPIEOSA-N.
| Molecular formula | C27H38O3 |
|---|---|
| Molecular weight | 410.6 g/mol |
| IUPAC name | (E,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpent-2-en-1-one |
| InChIKey | KKDBQSPKXAUHPH-NRCQPIEOSA-N |
| SMILES | C[C@H](/C=C/C(=O)C1CC1)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C\C=C/4\C[C@H](C[C@@H](C4=C)O)O)C |
Computed by PubChem (NCBI)
Synonyms:
Calcipotriol, anhydrous impurity A [EP], Calcipotriol EP Impurity A, Calcipotriol, anhydrous specified impurity A [EP], CALCIPOTRIOL IMPURITY A [EP IMPURITY], CALCIPOTRIENE IMPURITY A [USP IMPURITY], CALCIPOTRIOL MONOHYDRATE IMPURITY A [EP IMPURITY], (22E)-1alpha-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrocholecalciferol, (22E)-1alpha-hydroxy-24-oxo-26,27-cyclo-22,23-didehydrovitamin D3