| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:23 UTC |
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| Update Date | 2025-03-25 00:47:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161039 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12N4O2 |
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| Molecular Mass | 268.096 |
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| SMILES | NC1=NC(O)=NC1(c1ccc(O)cc1)c1cccnc1 |
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| InChI Key | PBZHVDFNUKFZHM-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amidinesazacyclic compoundsbenzene and substituted derivativescarboximidamidesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesimidazolesimidolactamsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridine1-hydroxy-2-unsubstituted benzenoidorganic 1,3-dipolar compoundamidinecarboximidamidepropargyl-type 1,3-dipolar organic compoundpyridineorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compound |
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