Aniline D-Glucuronide Sodium Salt
Product Code
TRC-A662500
CAS Number
Product Format
Neat
Molecular Formula
C12 H14 N O6 . Na
Molecular Weight
291.23
API Family
AnilineProduct Categories
Product Type
MetaboliteAlternate CAS Number
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Aniline D-Glucuronide Sodium Salt
CAS Number
116866-42-3
Molecular Formula
C12 H14 N O6 . Na
Molecular Weight
291.23
Accurate Mass
291.0719
SMILES
O[C@@H]1[C@@H](O)C(Nc2ccccc2)O[C@@H]([C@H]1O)C(=O)O[Na]
InChI
InChI=1S/C12H15NO6.Na/c14-7-8(15)10(12(17)18)19-11(9(7)16)13-6-4-2-1-3-5-6;/h1-5,7-11,13-16H,(H,17,18);/q;+1/p-1/t7-,8-,9+,10-,11?;/m0./s1
IUPAC
[(2S,3S,4S,5R)-6-anilino-3,4,5-trihydroxy-tetrahydropyran-2-carbonyl]oxysodium
Alternate CAS Number
704205-80-1; β-isomer: 92117-30-1
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
API Family
Purity
>95% (HPLC)