(2S,3S,4S,5R)-3,4,5-triacetyloxy-6-(3-phenoxybenzoyl)oxyoxane-2-carboxylic acid
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(2S,3S,4S,5R)-3,4,5-triacetyloxy-6-(3-phenoxybenzoyl)oxyoxane-2-carboxylic acid
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CAS No:
90720-07-3
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Formula:
C25H24O12
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Chemical Name:
(2S,3S,4S,5R)-3,4,5-triacetyloxy-6-(3-phenoxybenzoyl)oxyoxane-2-carboxylic acid
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Synonyms:
90720-07-3;DTXSID80920217;2,3,4-Tri-O-acetyl-1-O-(3-phenoxybenzoyl)hexopyranuronic acid;D-Glucopyranuronic acid, 2,3,4-triacetate 1-(3-phenoxybenzoate)
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CAS No:
(2S,3S,4S,5R)-3,4,5-triacetyloxy-6-(3-phenoxybenzoyl)oxyoxane-2-carboxylic acid Basic Attributes
516.4 g/mol
516.12677620 g/mol
Computed Properties
Molecular Weight:516.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:516.12677620
Monoisotopic Mass:516.12677620
Topological Polar Surface Area:161
Heavy Atom Count:37
Complexity:851
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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