Merck, 614106-100MG, Cholic acid-2,2,3,4,4-d5
Size:100 mg, 98 atom % D, 98% (CP)
Catalog Number: 614106-100MG
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Pack Size100 mg
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| NACRES | NA.12 |
|---|---|
| PubChem Substance ID | 329759482 |
| UNSPSC Code | 12352106 |
| MDL number | MFCD08702879 |
| InChI | 1S/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/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1/i8D2,10D2,15D |
| SMILES string | [2H][C@@]1(O)C([2H])([2H])C[C@@]2(C)[C@@](C[C@@H](O)[C@]3([H])[C@]2([H])C[C@H](O)[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@@H](CCC(O)=O)C)([H])C1([2H])[2H] |
| InChI key | BHQCQFFYRZLCQQ-VRLVFLRJSA-N |
| isotopic purity | 98 atom % D |
| assay | 98% (CP) |
| form | solid |
| technique(s) | mass spectrometry (MS): suitable |
| mp | 200-201 °C (lit.) |
| mass shift | M+5 |
| Quality Level | 200 |
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