Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:46:58 UTC |
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Update Date | 2025-03-21 18:01:08 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00031256 |
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Frequency | 118.0 |
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Structure | |
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Chemical Formula | C9H10O4 |
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Molecular Mass | 182.0579 |
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SMILES | O=C(OCCO)c1ccc(O)cc1 |
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InChI Key | GFHGEIJFEHZKHZ-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 | p-hydroxybenzoic acid alkyl esters |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalcohols and polyolsbenzoyl derivativescarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | alcoholbenzoyl1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativep-hydroxybenzoic acid alkyl esteraromatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterphenolhydrocarbon derivativeorganooxygen compound |
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