| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:13 UTC |
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| Update Date | 2025-03-21 18:32:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091295 |
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| Frequency | 30.7 |
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| Structure | |
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| Chemical Formula | C10H8O3 |
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| Molecular Mass | 176.0473 |
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| SMILES | C=CC(=O)c1ccccc1C(=O)O |
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| InChI Key | NJVBGHSJHNPENP-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 compoundsalpha,beta-unsaturated ketonesaryl ketonesbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compounds |
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| Substituents | carboxylic acidbenzoylalpha,beta-unsaturated ketonecarboxylic acid derivativeketonearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivative1-carboxy-2-haloaromatic compoundbenzoic acidorganooxygen compoundaryl ketone |
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