| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:29 UTC |
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| Update Date | 2025-03-25 00:56:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221004 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H3F3N2O4 |
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| Molecular Mass | 236.0045 |
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| SMILES | O=C(O)c1cnc(C(F)(F)F)nc1C(=O)O |
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| InChI Key | SAWWXEONDPGUDT-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 | alkyl fluoridesazacyclic compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundazacyclealkyl fluorideorganofluorideheteroaromatic compoundpyrimidine-5-carboxylic acidcarboxylic acid derivativeorganohalogen compoundorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundalkyl halidehydrocarbon derivativeorganic nitrogen compoundpyrimidine-6-carboxylic acidorganooxygen compound |
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