| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:59 UTC |
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| Update Date | 2025-03-21 18:01:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00031288 |
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| Frequency | 117.9 |
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| Structure | |
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| Chemical Formula | C6H8O5 |
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| Molecular Mass | 160.0372 |
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| SMILES | CC(=O)OCCC(=O)C(=O)O |
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| InChI Key | QDSWHASNFADAHJ-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 | keto acids and derivatives |
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| Subclass | short-chain keto acids and derivatives |
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| Direct Parent | short-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxideorganic oxygen compoundcarboxylic acid esteralpha-keto aciddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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