| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:37 UTC |
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| Update Date | 2025-03-25 00:48:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02170691 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6N2O5 |
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| Molecular Mass | 186.0277 |
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| SMILES | COC(=O)c1[nH]c(=O)[nH]c(=O)c1O |
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| InChI Key | FTCBIBSKWOIBRZ-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 | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidinecarboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidineslactamsmethyl estersmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonesvinylogous acidsvinylogous amides |
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| Substituents | lactamaromatic heteromonocyclic compoundpyrimidonehydroxypyrimidinecarboxylic acid derivativeorganic oxidemethyl esterorganonitrogen compoundorganopnictogen compoundpyrimidine-6-carboxylic acidvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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