| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:03 UTC |
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| Update Date | 2025-03-21 17:56:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00003965 |
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| Frequency | 1446.8 |
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| Structure | |
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| Chemical Formula | C13H10O2 |
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| Molecular Mass | 198.0681 |
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| SMILES | O=C(O)c1ccccc1-c1ccccc1 |
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| InChI Key | ILYSAKHOYBPSPC-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 | benzoic acids and derivatives |
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| Direct Parent | benzoic acids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compounds |
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| Substituents | carboxylic acidbenzoylcarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivative1-carboxy-2-haloaromatic compoundbenzoic acidorganooxygen compound |
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