2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate
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2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate
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CAS No:
221287-90-7
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Formula:
C20H22O12
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Chemical Name:
2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate
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Synonyms:
Methyl 1-(2-Carboxyphenyl)-2,3,4-tri-O-acetyl-beta-D-glucopyranuronate;CTK8E8669;AKOS030241799;Methyl 1-(2-Carboxyphenyl)-2,3,4-tri-O-acetyl-|A-D-glucopyranuronate;2-[(2R,3R,4R,5R)-3,4,5-Triacetyloxy-6-methoxycarbonyloxan-2-yl]oxybenzoic acid
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CAS No:
2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate Basic Attributes
454.4
454.111126
2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate Use and Manufacturing
An intermediate in the synthesis of the metabolite of Nitazoxanide
Computed Properties
Molecular Weight:454.4
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:11
Exact Mass:454.11112613
Monoisotopic Mass:454.11112613
Topological Polar Surface Area:161
Heavy Atom Count:32
Complexity:734
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-Carboxyphenyl -D-Glucopyranosiduronic Acid 6-Methyl Ester Triacetate
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