5-Bromo-4-chloro-3-indolyl Beta-D-glucuronide, Cyclohexylammonium Salt
Product Specifications
CAS Number
114162-64-0
Synonyms
β-D-Glucopyranosiduronic acid, 5-bromo-4-chloro-1H-indol-3-yl, compd. with cyclohexanamine (1:1); X-Gluc; 5-Bromo-4-chloro-3-indolyl β-D-glucuronide Cyclohexylammonium Salt
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
NC1CCCCC1.O[C@@H]2[C@@H](O)[C@H](Oc3c[nH]c4ccc(Br)c(Cl)c34)O[C@@H]([C@H]2O)C(=O)O
Molecular Formula
C14 H13 Br Cl N O7 . C6 H13 N
Molecular Weight
521.79
InChI
InChI=1S/C14H13BrClNO7.C6H13N/c15-4-1-2-5-7(8(4)16)6(3-17-5)23-14-11(20)9(18)10(19)12(24-14)13(21)22;7-6-4-2-1-3-5-6/h1-3,9-12,14,17-20H,(H,21,22);6H,1-5,7H2/t9-,10-,11+,12-,14+;/m0./s1
Additionnal Information
IUPAC name: (2S,3S,4S,5R,6S)-6-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;cyclohexanamine
Shipping Conditions
Room Temperature
Storage Conditions
-20°C
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