| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:57 UTC |
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| Update Date | 2025-03-25 00:59:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237743 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14O9 |
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| Molecular Mass | 266.0638 |
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| SMILES | O=C1CC(O)C(O)(C(=O)O)OC1C(O)C(O)CO |
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| InChI Key | LEMPSRMGZWGJBV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyrans |
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| Subclass | pyran carboxylic acids and derivatives |
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| Direct Parent | pyran carboxylic acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesbeta hydroxy acids and derivativescarboxylic acidscyclic ketoneshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | carbonyl groupcarboxylic acidalpha-hydroxy acidcyclic ketonecarboxylic acid derivativeketonebeta-hydroxy acidorganic oxidealiphatic heteromonocyclic compoundhemiacetaloxaneprimary alcoholalcoholpyran carboxylic acid or derivativeshydroxy acidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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