| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:51 UTC |
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| Update Date | 2025-03-21 18:35:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00107546 |
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| Frequency | 25.0 |
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| Structure | |
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| Chemical Formula | C13H22O11 |
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| Molecular Mass | 354.1162 |
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| SMILES | O=C(O)C1CC(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |
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| InChI Key | VLPFTWOKHNLLOS-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 | alcohols and polyols |
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| Direct Parent | cyclohexanols |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidscyclitols and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesprimary alcohols |
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| Substituents | carbonyl groupcarboxylic acidcyclohexanolmonosaccharidecyclitol or derivativeshydroxy acidcyclic alcoholcarboxylic acid derivativeoxacyclebeta-hydroxy acidsaccharideorganic oxidemonocarboxylic acid or derivativesacetalaliphatic heteromonocyclic compoundhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compound |
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