| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:30 UTC |
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| Update Date | 2025-03-25 00:58:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232135 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H22O2 |
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| Molecular Mass | 210.162 |
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| SMILES | CCC1(CCCCC(=O)O)CC=CCC1 |
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| InChI Key | BNZKUPVVRRBUFP-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 | carbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbocyclic fatty acidcarbonyl groupcarboxylic acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic homomonocyclic compoundhydrocarbon derivativemedium-chain fatty acidorganooxygen compound |
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