| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:40 UTC |
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| Update Date | 2025-03-25 00:48:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02170802 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H14O7 |
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| Molecular Mass | 282.074 |
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| SMILES | COC(=O)c1ccccc1C(=O)OCC(O)C(=O)OC |
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| InChI Key | KGPHTGRDZRKPEX-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 acid esters |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzoyl derivativescarbonyl compoundshydrocarbon derivativesmethyl estersmonosaccharidesorganic oxidessecondary alcoholssugar acids and derivativestricarboxylic acids and derivatives |
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| Substituents | alcoholcarbonyl groupbenzoylmonosaccharidetricarboxylic acid or derivativesbenzoate estercarboxylic acid derivativearomatic homomonocyclic compoundsaccharideorganic oxidemethyl esterorganic oxygen compoundglyceric_acidcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganooxygen compound |
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