| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:43 UTC |
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| Update Date | 2025-03-25 00:56:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221539 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16O6 |
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| Molecular Mass | 256.0947 |
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| SMILES | O=C(O)CCCC1(O)C=CC(=O)C1CCC(=O)O |
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| InChI Key | IOOIDBQJCKRHMA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | carbocyclic fatty acids |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carboxylic acidscyclic ketonesdicarboxylic acids and derivativesfatty acylshydrocarbon derivativeshydroxy fatty acidsorganic oxidesshort-chain hydroxy acids and derivativestertiary alcohols |
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| Substituents | alcoholcarbocyclic fatty acidcarbonyl groupcarboxylic acidshort-chain hydroxy acidcyclic ketonecarboxylic acid derivativeketonetertiary alcoholorganic oxideorganic oxygen compoundaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativehydroxy fatty acidorganooxygen compound |
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