904163

Glycochenodeoxycholic-2,2,4,4-d₄ acid solution

100 μg/mL in methanol, ≥98 atom % D, ≥97% (CP)

• Empirical Formula (Hill Notation): C₂₆D₄H₃₉NO₅
• Molecular Weight: 453.65
• UNSPSC Code: 12352106
• NACRES: NA.24

Properties

• isotopic purity: ≥98 atom % D
• Quality Level: 200
• Assay: ≥97% (CP)
• form: solution
• concentration: 100 μg/mL in methanol
• technique(s): mass spectrometry (MS): suitable
• mass shift: M+4
• storage temp.: −20°C
• SMILES string: O[C@H](C1)C(C2[C@]([C@@H]([C@H](C)CCC(NCC(O)=O)=O)CC2)(C)CC3)C3[C@]4(C)[C@@]1([H])C([2H])([2H])[C@H](O)C([2H])([2H])C4
• InChI: 1S/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16+,17-,18-,19?,20?,21-,24?,25+,26-/m1/s1/i8D2,12D2
• InChI key: GHCZAUBVMUEKKP-KWFHFAJKSA-N

Description

Packaging

1 mL in ampule

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.

Safety Information

• Pictograms: GHS02,GHS06,GHS08
• Signal Word: Danger
• Hazard Statements: H225,H301 + H311 + H331,H370
• Precautionary Statements: P210 - P260 - P280 - P301 + P310 + P330 - P308 + P311 - P370 + P378 - P403 + P233
• Hazard Classifications: Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Flam. Liq. 2 - STOT SE 1
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 2
• Flash Point(F): 49.5 °F
• Flash Point(C): 9.7 °C