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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Proglumetacin-[d4] Dioxalate

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General Information
Catalog: BLP-003892
CAS: 1346597-85-0
Molecular Formula: C48H56D4ClN5O12
Molecular Weight: 1028.53
Chemical Structure
Proglumetacin-[d4] Dioxalate
Description Proglumetacin-[d4] Dioxalate, is the labelled analogue of Proglumetacin, which is a nonsteroidal anti-inflammatory drug.
Synonyms (+/-)-Proglumetacin-d4 Dioxalate; Proglumetacin-d4 Dioxalate
IUPAC Name 3-[4-[2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxy-1,1,2,2-tetradeuterioethyl]piperazin-1-yl]propyl 4-benzamido-5-(dipropylamino)-5-oxopentanoate;oxalic acid
Related CAS 57132-53-3 (unlabelled free base)
Canonical SMILES CCCN(CCC)C(=O)C(CCC(=O)OCCCN1CCN(CC1)CCOC(=O)CC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C)NC(=O)C5=CC=CC=C5.C(=O)(C(=O)O)O
InChI InChI=1S/C46H58ClN5O8.C2H2O4/c1-5-21-51(22-6-2)46(57)40(48-44(55)34-11-8-7-9-12-34)18-20-42(53)59-29-10-23-49-24-26-50(27-25-49)28-30-60-43(54)32-38-33(3)52(41-19-17-37(58-4)31-39(38)41)45(56)35-13-15-36(47)16-14-35;3-1(4)2(5)6/h7-9,11-17,19,31,40H,5-6,10,18,20-30,32H2,1-4H3,(H,48,55);(H,3,4)(H,5,6)/i28D2,30D2;
InChI Key PXDVAHRYYJUKDC-OHPGHNMMSA-N
Melting Point 189-191°C(dec.)
Purity >98%
Solubility Soluble in DMSO, Methanol
Appearance White to Off-white Powder
Storage Store at-20°C
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