3-(3-methoxy-4-sulfooxyphenyl)propanoic acid
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3-(3-methoxy-4-sulfooxyphenyl)propanoic acid
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CAS No:
86321-33-7
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Formula:
C10H12O7S
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Chemical Name:
3-(3-methoxy-4-sulfooxyphenyl)propanoic acid
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Synonyms:
Dihydroferulic acid 4-sulfate;3-[3-methoxy-4-(sulfooxy)phenyl]propanoic acid;86321-33-7;3-(3-methoxy-4-sulfooxy-phenyl)propanoic Acid;3-(3-methoxy-4-sulfooxyphenyl)propanoic acid;SCHEMBL17938813;CHEBI:174634;DTXSID301006709;ZINC5999167;AKOS030239941;3-(3-methoxy-4-sulooxyphenyl)propanoic acid;FT-0666932;Q59348128
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CAS No:
Drug Information
3-[3-Methoxy-4-(sulfooxy)phenyl]propanoic acid is a known human metabolite of Dihydroferulic acid.
Computed Properties
Molecular Weight:276.26
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:276.03037389
Monoisotopic Mass:276.03037389
Topological Polar Surface Area:119
Heavy Atom Count:18
Complexity:372
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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