| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:39 UTC |
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| Update Date | 2025-03-25 00:46:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02152664 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H8N2O2 |
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| Molecular Mass | 176.0586 |
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| SMILES | NC(=C=O)C(=O)c1ccccc1N |
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| InChI Key | MFEPPWNNVVAHGG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzoyl derivatives |
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| Direct Parent | benzoyl derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl ketoneshydrocarbon derivativesmonoalkylaminesorganic oxidesorganopnictogen compoundsvinylogous amidesynolates |
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| Substituents | vinylogous amidebenzoylketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundynolateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineprimary amineorganic nitrogen compoundamineorganooxygen compoundaryl ketone |
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