Valproic Acid Β-D-Glucuronide

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Catalog Number
ACM60113839
Product Name
Valproic Acid Β-D-Glucuronide
Structure
Structure
CAS
60113-83-9
Category
Heterocyclic Organic Compound
Synonyms
1-(2-Propylpentanoate) β-D-Glucopyranuronic Acid; 1-O-Valproyl-β-D-glucopyranuronic Acid; Dipropylacetate Glucuronide; VPA-G; Valproate Glucuronide; Valproic Acid Glucuronide;
IUPAC Name
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-propylpentanoyloxy)oxane-2-carboxylic acid
Molecular Weight
320.34
Molecular Formula
C14H24O8
Canonical SMILES
CCCC(CCC)C(=O)O[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C(=O)O)O)O)O
InChI Key
XXKSYIHWRBBHIC-JVWRJRKNSA-N
Boiling Point
491.9ºC at 760 mmHg
Melting Point
118-120 °C
Flash Point
178ºC
Density
1.33g/cm³
Appearance
Pale Yellow Solid
Exact Mass
320.14700
H-Bond Acceptor
8
H-Bond Donor
4
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