| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:17 UTC |
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| Update Date | 2025-03-25 00:57:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225075 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H5N3O4 |
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| Molecular Mass | 183.028 |
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| SMILES | Nc1cnc(C(=O)O)c(C(=O)O)n1 |
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| InChI Key | VQSLBMIIGKPKFT-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 | diazines |
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| Subclass | pyrazines |
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| Direct Parent | pyrazine carboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary amines |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundazacycleamino acid or derivativesamino acidheteroaromatic compoundcarboxylic acid derivativeorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundpyrazine carboxylic acidhydrocarbon derivativeprimary amineorganic nitrogen compoundimidolactamamineorganooxygen compound |
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