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3-Hydroxy-7,12-diketocholanoic Acid, TRC
Tekniske data
Tekniske data
| Kemisk navn eller materiale | 3-Hydroxy-7,12-diketocholanoic Acid |
| CAS | 517-33-9 |
| Renhedsgrad noter | HPLC |
| Molekylær formel | C24H36O5 |
| Mængde | 10 mg |
| Synonym | 3alpha-Hydroxy-7,12-dioxo-5beta-cholan-24-oic Acid, 3alpha-Hydroxy-7,12-dioxo-5beta-cholanic Acid, (3alpha,5beta)-3-Hydroxy-7,12-dioxocholan-24-oic Acid, 3alpha-Hydroxy-7,12-diketo-5beta-cholanic Acid, 3alpha-Hydroxy-7,12-diketo-5beta-cholanoic Acid, 3alpha-Hydroxy-7,12-diketocholanic Acid, 3alpha-Hydroxy-7,12-dioxo-5beta-cholan-24-oic Acid, 3alpha-Hydroxy-7,12-dioxo-5beta-cholanoic Acid, 5beta-Cholanic acid-3alpha-ol-7,12-dione, 7,12-Diketo-3alpha-hydroxy-5beta-cholanic Acid, 7,12-Diketolithocholic Acid, 7,12-Dioxolithocholic Acid, Reductodehydrocholic Acid |
| InChI formel | InChI=1S/C24H36O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-18,22,25H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,22+,23+,24-/m1/s1 |
| SMIL | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]4(C)CC[C@@H](O)C[C@H]4CC3=O |
| IUPAC navn | (4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxo-2,3,4,5,6,8,9,11,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
| Molekylvægt (g/mol) | 404.54 |
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