4-Aminobiphenyl-d5 Beta-D-Glucuronide Sodium Salt
Product Code
TRC-A601792
Product Format
Neat
Molecular Formula
C18H13D5NNaO6
Molecular Weight
372.36
Product Categories
Product Type
Stable Isotope LabelledUnlabelled CAS Number
Product Information
Chemical Data
Analyte Name
4-Aminobiphenyl-d5 beta-D-Glucuronide Sodium Salt
Molecular Formula
C18H13D5NNaO6
Molecular Weight
372.36
Accurate Mass
372.13
SMILES
O[C@@H]([C@H](O)[C@H]1O)[C@@H](C(O[Na])=O)O[C@H]1NC(C=C2)=CC=C2C3=C([2H])C([2H])=C([2H])C([2H])=C3[2H]
InChI
InChI=1S/C18H19NO6.Na/c20-13-14(21)16(18(23)24)25-17(15(13)22)19-12-8-6-11(7-9-12)10-4-2-1-3-5-10;/h1-9,13-17,19-22H,(H,23,24);/q;+1/p-1/t13-,14-,15+,16-,17+;/m0./s1/i1D,2D,3D,4D,5D;
IUPAC
sodium (2S,3S,4S,5R,6R)-6-(([1,1'-biphenyl]-4-yl-2',3',4',5',6'-d5)amino)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate
Unlabelled CAS Number
Salt: 116490-30-3
SIL Type
Deuterium
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
Product Description
A labelled metabolite of 4-Aminobiphenyl (4-ABP).
References: Green, M., et al.: Cancer Res., 47, 2028 (1987),
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