| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:07:25 UTC |
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| Update Date | 2025-03-24 21:02:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01651697 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H2O4 |
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| Molecular Mass | 125.9953 |
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| SMILES | O=Cc1c(O)c(=O)c1=O |
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| InChI Key | IRRJMKBDEXZGBC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-aldehydes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | cyclic ketoneshydrocarbon derivativesorganic oxidesorganooxygen compoundsvinylogous acids |
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| Substituents | aromatic homomonocyclic compoundvinylogous acidorganic oxidearyl-aldehydehydrocarbon derivativecyclic ketone |
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