Products 1325307-59-2
CAS 1325307-59-2 is the registry number for Ercalcidiol-13C3. Offered by: MedChemExpress. Available pack sizes: Get quote.
(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5-methyl-6-(113C)methyl(6,7-13C2)hept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol (CAS 1325307-59-2) is a chemical compound with the molecular formula C28H44O2 and a molecular weight of 415.6 g/mol. IUPAC name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5-methyl-6-(113C)methyl(6,7-13C2)hept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol. InChIKey: KJKIIUAXZGLUND-RQYUKPBQSA-N.
| Molecular formula | C28H44O2 |
|---|---|
| Molecular weight | 415.6 g/mol |
| IUPAC name | (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5-methyl-6-(113C)methyl(6,7-13C2)hept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol |
| InChIKey | KJKIIUAXZGLUND-RQYUKPBQSA-N |
| SMILES | C[C@H](/C=C/[C@H](C)[13C]([13CH3])([13CH3])O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C |
Computed by PubChem (NCBI)
Synonyms:
25-Hydroxyvitamin D2 (25,26,27-13C3)