| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:08 UTC |
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| Update Date | 2025-03-25 00:58:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231310 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H26O4 |
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| Molecular Mass | 258.1831 |
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| SMILES | CC1CC(C)(CCCC(C)C(=O)O)OC(C)(C)O1 |
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| InChI Key | KITIXWRWJROSAH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxanescarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesketalsmedium-chain fatty acidsmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidmethyl-branched fatty acidheterocyclic fatty acidfatty acidcarboxylic acid derivativebranched fatty acidmedium-chain hydroxy acidoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacetalketalaliphatic heteromonocyclic compoundhydrocarbon derivativemedium-chain fatty acidmeta-dioxaneorganoheterocyclic compoundorganooxygen compound |
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