| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:58 UTC |
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| Update Date | 2025-03-21 18:02:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00036074 |
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| Frequency | 98.3 |
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| Structure | |
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| Chemical Formula | C7H14O3 |
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| Molecular Mass | 146.0943 |
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| SMILES | CC1(O)CCC(O)C(O)C1 |
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| InChI Key | XBJMHUVWVLZROR-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 homomonocyclic compounds |
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| Alternative Parents | cyclitols and derivativeshydrocarbon derivativestertiary alcohols |
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| Substituents | tertiary alcoholcyclohexanolaliphatic homomonocyclic compoundcyclitol or derivativeshydrocarbon derivativecyclic alcohol |
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