Salicyl acyl glucuronide
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Salicyl acyl glucuronide
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CAS No:
29315-53-5
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Formula:
C13H14O9
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Chemical Name:
Salicyl acyl glucuronide
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Synonyms:
β-D-Glucopyranuronic acid,1-(2-hydroxybenzoate);Glucopyranosiduronic acid,1-salicylate,β-D-;Salicylic acid glucuronide;Salicylic acid,β-D-glucopyranuronosyl ester;Salicyl acyl glucuronide
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CAS No:
Computed Properties
Molecular Weight:314.24
XLogP3:0.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:314.06378202
Monoisotopic Mass:314.06378202
Topological Polar Surface Area:154
Heavy Atom Count:22
Complexity:426
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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