Synonym: 2α,12α-Dihydroxy-5β-cholanoic-2,2,4,4-d4 acid N-(carboxymethyl)amide; N-(3α,12α-Dihydroxy-24-oxocholan-24-yl-2-,2,4,4-d4)glycine; Glycodesoxycholic-2,2,4,4-d4 acid
CAS Number: 1069132-37-1
Empirical Formula (Hill Notation): C26D4H39NO5
Molecular Weight: 453.65
MDL Number: MFCD06658888
Linear Formula: C26D4H39NO5
Product Type: Chemical
| assay |
≥98% (CP) |
| form |
powder |
| InChI |
1S/C26H43NO5/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16-,17-,18+,19-,20+,21+,22+,25+,26-/m1/s1/i10D2,12D2 |
| InChI key |
WVULKSPCQVQLCU-JHVXYEQYSA-N |
| isotopic purity |
≥98 atom % D |
| mass shift |
M+4 |
| Quality Level |
200  |
| SMILES string |
[H][C@@]12[C@]([C@](CC([2H])([2H])[C@@H](O)C3([2H])[2H])(C)[C@]3([H])CC2)([H])C[C@H](O)[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(NCC(O)=O)=O |
| storage temp. |
−20°C |
| technique(s) |
mass spectrometry (MS): suitable |
| Packaging: |
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service . |
| Purity |
≥98% (CP) |
| Storage Temp. |
−20°C |
| UNSPSC |
12352106 |
GHS07