| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:49 UTC |
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| Update Date | 2025-03-25 00:52:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196190 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14O6 |
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| Molecular Mass | 218.079 |
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| SMILES | CC1=CCC(O)(C(=O)O)OC1C(O)CO |
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| InChI Key | QWOSPZZSFRRJIY-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 | pyrans |
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| Direct Parent | pyrans |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsalpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidalpha-hydroxy acidhydroxy acidcarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundpyranaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeprimary alcoholorganooxygen compound1,2-diol |
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