| Primary information |
|---|
| ID | 20514 |
| Pubchem ID | 9547243 |
| Name | Ercalcitriol |
| Description | Ercalcitriol is the active circulating metabolite of vitamin D2. Vitamin D2 is modified by 25-hydroxylase in the liver and 25-hydroxyvitamin D *-hydroxylase in the kidney to form the active metabolite; ercalcitriol; which is then metabolized by 25-hydroxyvitamin D-24-hydroxylase (24-OHase; CYP24A1; |
| Synonym | 1;25-Dihydroxycalciferol;1;25-Dihydroxyergocalciferol;1;25-Dihydroxyvitamin D2;1alpha;25-Dihydroxycalciferol;1alpha;25-Dihydroxyergocalciferol;1a;25-Dihydroxycalciferol;1Α;25-dihydroxycalciferol;1a;25 |
| Molecular Weight | 428.6472 |
| Formula | C28H44O3 |
| IUPAC | (1R;3S;5Z)-5-{2-[(1R;3aS;4E;7aR)-1-[(2R;3E;5S)-6-hydroxy-5;6-dimethylhept-3-en-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1;3-diol |
| SMILE | C[C@H](C=C[C@H](C)C(O)(C)C)[C@@]1([H])CC[C@@]2([H])C(CCC[C@]12C)=CC=C1C[C@@H](O)C[C@H](O)C1=C |
| PDB ID | NA |
| KEGG | NA |
| HMDB ID | HMDB0006225 |
| Melting Point (Degree C) | NA |
| Water Solubility | NA |
| Drugbank ID | NA |
| Receptor | NA |
| Reference | HMDB
|