Record Information |
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HMDB Status | predicted |
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Creation Date | 2024-02-20 23:36:17 UTC |
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Update Date | 2025-03-21 17:57:16 UTC |
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HMDB ID | HMDB0131175 |
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Metabolite Identification |
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DeepMet ID | DMID00006768 |
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Name | 3-(2-hydroxy-4-methoxyphenyl)propanoic acid |
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Frequency | 757.6 |
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Structure | |
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Chemical Formula | C10H12O4 |
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Molecular Mass | 196.0736 |
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SMILES | COc1ccc(CCC(=O)O)c(O)c1 |
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InChI Key | CGWRDLSMEFSEDN-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | phenylpropanoids and polyketides |
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Class | phenylpropanoic acids |
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Subclass | phenylpropanoic acids |
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Direct Parent | phenylpropanoic acids |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolescarbonyl compoundscarboxylic acidshydrocarbon derivativesmethoxybenzenesmethoxyphenolsmonocarboxylic acids and derivativesorganic oxidesphenoxy compounds |
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Substituents | phenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acid3-phenylpropanoic-acidmethoxyphenol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethercarboxylic acid derivativemethoxybenzenearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundanisolephenolhydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compound |
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