Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:43 UTC |
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Update Date | 2025-03-21 18:34:46 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00102303 |
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Frequency | 26.6 |
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Structure | |
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Chemical Formula | C10H16O5 |
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Molecular Mass | 216.0998 |
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SMILES | O=C(O)CCCCCC=CC(O)C(=O)O |
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InChI Key | HUBLXPUIDKMSMW-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 acyclic compounds |
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Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty alcoholshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsorganic oxidessecondary alcohols |
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Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy acidcarboxylic acid derivativemedium-chain hydroxy acidorganic oxideorganic oxygen compoundfatty alcoholsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativemedium-chain fatty acidhydroxy fatty acidorganooxygen compound |
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