| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:17 UTC |
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| Update Date | 2025-03-25 00:55:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211200 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20N4O12P2 |
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| Molecular Mass | 474.0553 |
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| SMILES | CC(=O)NC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(CO)OC1n1ccc(N)nc1=O |
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| InChI Key | JLPQNORWWLISOX-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 | pyrimidones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesamino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholsprimary aminessecondary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundamino acid or derivativesmonosaccharidepyrimidonecarboxylic acid derivativesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholimidolactamacetamidealcoholcarbonic acid derivativeazacycleheteroaromatic compoundcarboxamide groupoxacyclesecondary carboxylic acid amideorganic oxygen compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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