| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:42:42 UTC |
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| Update Date | 2025-03-25 01:09:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02298791 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H5O3+ |
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| Molecular Mass | 137.0233 |
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| SMILES | O=CC(=O)c1cc[o+]cc1 |
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| InChI Key | GMCZBGSWXCFJGF-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 ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha ketoaldehydesheteroaromatic compoundshydrocarbon derivativesorganic cationsorganic oxidesoxacyclic compounds |
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| Substituents | aromatic heteromonocyclic compoundheteroaromatic compoundaldehydeoxacycleorganic oxidehydrocarbon derivativeorganic cationalpha-ketoaldehydeorganoheterocyclic compoundaryl ketone |
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