Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:20:51 UTC |
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Update Date | 2025-03-21 18:36:47 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00112381 |
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Frequency | 23.6 |
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Structure | |
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Chemical Formula | C8H14O3 |
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Molecular Mass | 158.0943 |
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SMILES | CC(=O)C1(O)CCC(O)CC1 |
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InChI Key | CLPOVZSDWNDNPM-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 | cyclic alcohols and derivativeshydrocarbon derivativesketonesorganic oxidestertiary alcohols |
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Substituents | carbonyl groupcyclohexanolcyclic alcoholketonetertiary alcoholorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivative |
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