| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:06 UTC |
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| Update Date | 2025-03-21 18:04:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048379 |
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| Frequency | 68.5 |
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| Structure | |
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| Chemical Formula | C8H12O5 |
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| Molecular Mass | 188.0685 |
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| SMILES | O=C(O)CC1CCCC(C(=O)O)O1 |
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| InChI Key | ZKBWQBNIHXAQPB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | c-glucuronides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkyl ethersdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acids |
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| Substituents | c-glucuronidecarbonyl groupethercarboxylic acidpyran carboxylic acid or derivativescarboxylic acid derivativepyran carboxylic aciddialkyl etheroxacycleorganic oxidepyranaliphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeoxaneorganoheterocyclic compound |
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