| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:13 UTC |
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| Update Date | 2025-03-21 18:05:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00055569 |
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| Frequency | 57.6 |
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| Structure | |
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| Chemical Formula | C8H16O5 |
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| Molecular Mass | 192.0998 |
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| SMILES | O=C(O)CCCCCCC(O)(O)O |
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| InChI Key | PSISSLFJIQDEPT-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 | carbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxidesortho acidsorthocarboxylic acid derivativesstraight chain fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidfatty acidcarboxylic acid derivativemedium-chain hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundortho acidhydrocarbon derivativemedium-chain fatty acidhydroxy fatty acidorthocarboxylic acid derivativeorganooxygen compound |
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