5-(1,3-benzothiazol-2-yl)-2,3,4,5-tetrahydroxypentanoic acid
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5-(1,3-benzothiazol-2-yl)-2,3,4,5-tetrahydroxypentanoic acid
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CAS No:
6641-94-7
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Formula:
C12H13NO6S
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Chemical Name:
5-(1,3-benzothiazol-2-yl)-2,3,4,5-tetrahydroxypentanoic acid
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Synonyms:
NSC45741;6641-94-7;CHEMBL2009132;NCI60_004081;5-C-(1,3-benzothiazol-2-yl)pentonic acid
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CAS No:
5-(1,3-benzothiazol-2-yl)-2,3,4,5-tetrahydroxypentanoic acid Basic Attributes
299.30 g/mol
299.04635831 g/mol
Computed Properties
Molecular Weight:299.30
XLogP3:-0.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:299.04635831
Monoisotopic Mass:299.04635831
Topological Polar Surface Area:159
Heavy Atom Count:20
Complexity:357
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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