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Cholic-2,2,4,4-d4 Acid, CDN
Specifications
Specifications
| Kemisk navn eller materiale | Cholic Acid-d4 |
| CAS | 116380-66-6 |
| Molekylær formel | C24 D4 H36 O5 |
| Mængde | 0.1 g |
| Synonym | Cholan-24-oic-2,2,4,4-d4 acid, 3,7,12-trihydroxy-, (3α,5β,7α,12α)- (9 CI, ACI), (3α,5β,7α,12α)-3,7,12-Trihydroxycholan-24-oic-2,2,4,4-d4 acid (ACI), Cholic acid-2,2,4,4-d4, Cholic acid-d4, Cholic-2,2,4,4-d4 Acid, Cholic Acid-2,2,4,4-D4 |
| InChI formel | InChI=1 S/C24H40O5/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/h13-20,22,25-27 H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1/i8D2,10D2 |
| SMIL | [2 H]C1([2 H])C[C@]2(C)[C@H]3 C[C@H](O)[C@]4(C)[C@H](CC[C@H]4 [C@@H]3 [C@H](O)C[C@@H]2 C([2 H])([2 H])[C@@H]1 O)[C@H](C)CCC(=O)O |
| IUPAC navn | (4 R)-4-[(3 R,5 S,7 R,8 R,9 S,10 S,12 S,13 R,14 S,17 R)-2,2,4,4-tetradeuterio-3,7,12-trihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1 H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
| Molekylvægt (g/mol) | 412.596 |
| Formel vægt | 412.313 g/mol |
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