Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:41:19 UTC |
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Update Date | 2025-03-25 00:47:00 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02158695 |
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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 | OCC(O)C(O)C1=CCC(O)CC1 |
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InChI Key | DPVNBYIWQFVVPV-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 | secondary alcohols |
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Geometric Descriptor | aliphatic homomonocyclic compounds |
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Alternative Parents | hydrocarbon derivativesprimary alcohols |
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Substituents | secondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativeprimary alcohol |
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