| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:13 UTC |
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| Update Date | 2025-03-21 18:07:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00069865 |
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| Frequency | 43.1 |
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| Structure | |
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| Chemical Formula | C14H16O10 |
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| Molecular Mass | 344.0743 |
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| SMILES | COc1cc(C(=O)O)ccc1OC1C(C(=O)O)OC(O)C(O)C1O |
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| InChI Key | MICNTCRREOYAQP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | tannins |
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| Subclass | hydrolyzable tannins |
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| Direct Parent | hydrolyzable tannins |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl aryl ethersanisolesbenzoic acidsbenzoyl derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesglucuronic acid derivativeshemiacetalshydrocarbon derivativesm-methoxybenzoic acids and derivativesmethoxybenzenesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesphenoxy compoundspyran carboxylic acidssecondary alcohols |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupethercarboxylic acidglucuronic acid or derivativesaromatic heteromonocyclic compoundbenzoylmonosaccharidealkyl aryl ethercarboxylic acid derivativepyran carboxylic acidsaccharideorganic oxidehemiacetalbenzoic acidm-methoxybenzoic acid or derivativesoxaneorganoheterocyclic compound1,2-diolhydrolyzable tanninalcoholpyran carboxylic acid or derivativesbenzoic acid or derivativesmethoxybenzeneoxacycleorganic oxygen compoundpyrananisolesecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compound |
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