Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:51:00 UTC |
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Update Date | 2025-03-21 18:02:53 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00040926 |
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Frequency | 84.2 |
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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 | CC(O)C(O)c1ccc(C(=O)O)cc1 |
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InChI Key | YVNGDGFGLVSSBD-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | phenylpropanes |
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Direct Parent | phenylpropanes |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1,2-diolsaromatic alcoholsbenzoic acidsbenzoyl derivativescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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Substituents | aromatic alcoholalcoholcarboxylic acidbenzoylbenzoic acid or derivativescarboxylic acid derivativephenylpropanearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzoic acidorganooxygen compound1,2-diol |
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