| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:11 UTC |
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| Update Date | 2025-03-21 18:28:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074592 |
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| Frequency | 39.8 |
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| Structure | |
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| Chemical Formula | C6H12O5 |
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| Molecular Mass | 164.0685 |
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| SMILES | O=C(O)CCCCC(O)(O)O |
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| InChI Key | NDFAENUNHYIQFH-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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