| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:25:12 UTC |
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| Update Date | 2025-03-24 16:50:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00975101 |
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| Frequency | 1.5 |
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| Structure | |
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| Chemical Formula | C6H8O4 |
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| Molecular Mass | 144.0423 |
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| SMILES | O=CC=CC(O)C(=O)CO |
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| InChI Key | NANDWSSMDMVFKL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty alcohols |
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| Direct Parent | fatty alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyloinsalpha-hydroxy ketoneshydrocarbon derivativesmedium-chain aldehydesmonosaccharidesorganic oxidessecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupmonosaccharidealdehydealpha-hydroxy ketonemedium-chain aldehydeketonesaccharideorganic oxideorganic oxygen compoundfatty alcoholacyloinsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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