| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:57 UTC |
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| Update Date | 2025-03-25 00:50:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02178448 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H11N3O3 |
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| Molecular Mass | 233.08 |
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| SMILES | Cc1cccc2c(=O)nc(NCC(=O)O)[nH]c12 |
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| InChI Key | WJROLNOPYSDFBH-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 | quinazolinamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidpyrimidonealpha-amino acid or derivativescarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundvinylogous amideazacycleheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic aminemonocarboxylic acid or derivativesorganic oxygen compoundquinazolinaminehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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