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Ursodeoxycholic Acid-d5 Methyl Ester, TRC
Specifications
Specifications
| Chemical Name or Material | Ursodeoxycholic Acid-d5 Methyl Ester |
| CAS | 93701-19-0 |
| Molecular Formula | C25H37D5O4 |
| Quantity | 1 mg |
| Synonym | (3alpha,5beta,7beta)-3,7-Dihydroxycholan-24-oic-2,2,3,4,4-d5 Acid Methyl Ester, 3alpha,7beta-Dihydroxy-5beta-cholanic Acid-d5 Methyl Ester, Methyl 3alpha,7beta-Dihydroxy-5beta-cholanoate-d5, Methyl Ursodeoxycholate-d5 |
| InChI Formula | InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21+,23+,24+,25-/m1/s1/i9D2,13D2,17D |
| SMILES | [2H]C1([2H])C[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3[C@@H](O)C[C@@H]2C([2H])([2H])[C@]1([2H])O)[C@H](C)CCC(=O)OC |
| IUPAC Name | methyl (4R)-4-[(3R,5R,7S,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7-dihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate |
| Molecular Weight (g/mol) | 411.63 |
| Formula Weight | 411.3397 |
Product Title
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