| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:35 UTC |
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| Update Date | 2025-03-25 00:47:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02163766 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16O4 |
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| Molecular Mass | 188.1049 |
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| SMILES | CC1(C=O)CCC(O)C(O)C1(C)O |
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| InChI Key | NOPKRCASCRTUJR-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 | aldehydescyclitols and derivativeshydrocarbon derivativesorganic oxidestertiary alcohols |
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| Substituents | carbonyl groupcyclohexanolaldehydecyclitol or derivativescyclic alcoholtertiary alcoholorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivative |
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