Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:38:49 UTC |
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Update Date | 2025-03-25 00:46:04 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02153056 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H10N4O3 |
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Molecular Mass | 210.0753 |
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SMILES | NC(=O)c1cc(N)c(N)c(C(=O)O)c1N |
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InChI Key | VSAYHFTVAVDQTI-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 | benzoic acids and derivatives |
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Direct Parent | benzamides |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-carboxy-2-haloaromatic compoundsamino acidsbenzoic acidsbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminesprimary carboxylic acid amidesvinylogous amides |
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Substituents | primary carboxylic acid amidecarboxylic acidamino acid or derivativesamino acidbenzoylcarboxylic acid derivativebenzamideorganic oxideorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundbenzoic acidvinylogous amidecarboxamide grouparomatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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