| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:28 UTC |
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| Update Date | 2025-03-25 00:51:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186404 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17N3O8 |
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| Molecular Mass | 331.1016 |
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| SMILES | NC1C(O)CC(n2c(C(=O)O)cc(=O)[nH]c2=O)OC1C(O)CO |
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| InChI Key | YRUDYPVZRAWKCJ-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 compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkylaminesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyrimidonessecondary alcoholsvinylogous amides |
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| Substituents | lactamcarboxylic acidaromatic heteromonocyclic compoundpyrimidonecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholpyrimidine-6-carboxylic acidalcoholvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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