Basic Information |
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| Product Name: | DEOXYCHOLIC ACID-24-13C |
| CAS: | 52886-37-0 |
| English Synonyms: | DESOXYCHOLIC ACID-24-13C ; 3ALPHA,12ALPHA-DIHYDROXY-5BETA-CHOLANIC ACID-24-13C ; 7-DEOXYCHOLIC ACID-24-13C ; DEOXYCHOLIC ACID-24-13C |
| MDL Number.: | MFCD00190301 |
| H bond acceptor: | 4 |
| H bond donor: | 3 |
| Smile: | C[C@H](CC[13C](=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
| InChi: | InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1/i22+1 |
| InChiKey: | InChIKey=KXGVEGMKQFWNSR-JJUQXLBJSA-N |
Property |
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| Melting Point: | 171-174 DEG C |
| Comments: | MASS SHIFT: M+1 WGK: 3 |
| Information: | ISOTOPIC PURITY: 99 ATOM% 13C MW: 393.56 BY ATOM% CALCULATION |
Safety information |
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