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Home > Product > Heterocyclic Organic Compounds > Bumetanide β-D-glucuronide

Bumetanide β-D-glucuronide | CAS Number: 102623-14-3

Catalog Number
ACM102623143
Product Name
Bumetanide β-D-glucuronide
Structure
CAS Number
102623-14-3
IUPAC Name
(2S,3S,4S,5R,6S)-6-[3-(butylamino)-4-phenoxy-5-sulfamoylbenzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Synonyms
1-[3-(Aminosulfonyl)-5-(butylamino)-4-phenoxybenzoate]-β-D-glucopyranuronic Acid; Bumetanide Glucuronide;
Molecular Weight
540.54
Exact Mass
540.14100
Molecular Formula
C23H28N2O11S
Purity
96%
SMILES
CCCCNC1=C(C(=CC(=C1)C(=O)OC2C(C(C(C(O2)C(=O)O)O)O)O)S(=O)(=O)N)OC3=CC=CC=C3
InChIKey
MXEVQINQQGRZRQ-RZUKHUMYSA-N
H-Bond Donor
6
H-Bond Acceptor
13
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