| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:03 UTC |
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| Update Date | 2025-03-25 00:59:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237956 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10N2O3 |
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| Molecular Mass | 230.0691 |
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| SMILES | O=C(O)CCC(=O)c1cnc2ccccc2n1 |
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| InChI Key | YHYANNHBNHJTFH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | diazanaphthalenes |
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| Subclass | benzodiazines |
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| Direct Parent | quinoxalines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundsbenzenoidscarboxylic acidsdiazanaphthalenesgamma-keto acids and derivativesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrazines |
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| Substituents | carbonyl groupcarboxylic acidaryl alkyl ketonecarboxylic acid derivativeketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundquinoxalineazacycleheteroaromatic compoundgamma-keto acidmonocarboxylic acid or derivativesorganic oxygen compoundpyrazineketo acidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaryl ketone |
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