| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:36:12 UTC |
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| Update Date | 2025-03-24 22:08:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02005460 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H7O3+ |
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| Molecular Mass | 139.039 |
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| SMILES | CC(=O)c1[o+]cccc1O |
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| InChI Key | OMBZCVQCHWPPCQ-UHFFFAOYSA-O |
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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 alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | heteroaromatic compoundshydrocarbon derivativesorganic cationsorganic oxidesorganooxygen compoundsoxacyclic compoundsvinylogous acids |
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| Substituents | aryl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundoxacyclevinylogous acidorganic oxidehydrocarbon derivativeorganic cationorganoheterocyclic compound |
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