| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:20:38 UTC |
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| Update Date | 2025-03-25 01:23:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02386777 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6O2 |
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| Molecular Mass | 110.0368 |
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| SMILES | CCC(=C=C=O)C=O |
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| InChI Key | WOTCNDPQNPXSBI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | hydrocarbon derivatives |
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| Class | Not Available |
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| Subclass | hydrocarbon derivatives |
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| Direct Parent | hydrocarbon derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aldehydesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundaldehydehydrocarbon derivativeorganooxygen compound |
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