2-Nitrophenyl beta-D-glucuronide

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Catalog Number
ACM137629368
Product Name
2-Nitrophenyl beta-D-glucuronide
Structure
Structure
CAS
137629-36-8
Category
Heterocyclic Organic Compound
Synonyms
2-Nitrophenyl β-D-glucuronide potassium salt
IUPAC Name
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-nitrophenoxy)oxane-2-carboxylic acid
Molecular Weight
353.35
Molecular Formula
C12H12KNO9
Canonical SMILES
C1=CC=C(C(=C1)[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O
InChI
InChI=1S/C12H13NO9/c14-7-8(15)10(11(17)18)22-12(9(7)16)21-6-4-2-1-3-5(6)13(19)20/h1-4,7-10,12,14-16H,(H,17,18)/t7-,8-,9+,10-,12+/m0/s1
InChI Key
UADVJQJTJSOJOQ-GOVZDWNOSA-N
Melting Point
230-235 °C
Appearance
Light-yellow solid
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