Primary information |
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ID | 20522 |
Pubchem ID | 12918533 |
Name | Calcitroic acid |
Description | Calcitroic acid (1 alpha-hydroxy-23 carboxy-24;25;26;27-tetranorvitamin D(3)) is a metabolite of 1 alpha; 25-dihydroxyvitamin D(3) (calcitriol). It is soluble in water; and is excreted in urine. This deactivation process involves a series of oxidation reactions at C24 and C23 leading to side-chain c |
Synonym | Calcitroate;(3R)-3-[(1R;3AR;4E;7ar)- 4-[(2Z)-2-[(3R;5R)-3;5- dihydroxy-2-methylene-cyclohexylidene]ethylidene] -7a-methyl-2;3;3a;5;6;7-hexahydro-1H -inden-1-yl]butanoate;(3R)-3-[(1R;3AR;4E;7ar)- 4-[(2 |
Molecular Weight | 374.5137 |
Formula | C23H34O4 |
IUPAC | (3R)-3-[(1R;3aS;4E;7aR)-4-{2-[(1E;3S;5R)-3;5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]butanoic acid |
SMILE | [H][C@@]12CC[C@H]([C@H](C)CC(O)=O)[C@@]1(C)CCCC2=C/C=C1C[C@@H](O)C[C@H](O)C1=C |
PDB ID | NA |
KEGG | NA |
HMDB ID | HMDB0006472 |
Melting Point (Degree C) | NA |
Water Solubility | NA |
Drugbank ID | NA |
Receptor | NA |
Reference | HMDB
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