1alpha,25-Dihydroxyvitamin D2
trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Also Known As: Ercalcitriol|1,25-Dihydroxycalciferol|1,25-Dihydroxyvitamin D2|1,25-Dihydroxyergocalciferol|1alpha,25-Dihydroxyvitamin D2|Ercalcitriol (Standard)|25-Hydroxy Doxercalciferol|1,25-Dihyd|1|A,25-Dihydroxyvitamin D2|1,25-dihydoxyergocalciferol|1a,25-Dihydroxyvitamin D2|1alpha,25-dihydroxyergocalciferol|1a,25-Dihydroxycalciferol|1alpha,25-Dihydroxycalciferol|1a,25-Dihydroxy Vitamin D2|1,25-Dihydroxy vitamin D|1,25-dihydroxy Vitamin D2|1?,25-Dihydroxyvitamin D2|1a,25-Dihydroxyergocalciferol|RO-17-6218|1.alpha.,25-dihydroxyvitamin d2|1?,25-Dihydroxy Vitamin D2|1a,25 di-hydroxy vitamin D2|1-alpha,25-Dihydroxycalciferol|1|A,25-Dihydroxy Vitamin D2|1-alpha,25-Dihydroxyvitamin D2|1 25-DIHYDROXYVITAMIND2*|1 alpha ,25-Dihydroxyvitamin D2|EX-A4431|1| cent,25-Dihydroxy vitamin D2|8962AB|HY-32350R|Ro 17-6218|TQ0216|triethyl-2-fluoro-2-phosphonoacetate
| Molecular Formula | C28H44O3 |
|---|---|
| Molecular Weight | 428.32904 g/mol |
| LogP | 5.7267 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.32904 |
| Monoisotopic Mass | 428.32904 |
| Heavy Atoms | 31 |
| Complexity | 752.7095 |
Chemical Identifiers
| CAS Number | 54881-13-9 |
|---|---|
| SMILES | C[C@H](/C=C/[C@H](C)C(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C |
Product Overview
1alpha,25-Dihydroxyvitamin D2 (CAS 54881-13-9), with molecular formula C28H44O3 and molecular weight 428.32904 g/mol. IUPAC: trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol.
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