| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:35:30 UTC |
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| Update Date | 2025-03-21 18:46:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00146776 |
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| Frequency | 27.4 |
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| Structure | |
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| Chemical Formula | C9H14N3O7PS |
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| Molecular Mass | 339.029 |
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| SMILES | Nc1ccn(C2OC(CO)C(OP(O)(O)=S)C2O)c(=O)n1 |
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| InChI Key | WMKQWQYOQOHWPG-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 | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminessecondary alcoholstetrahydrofuransthiophosphate monoesters |
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| Substituents | aromatic heteromonocyclic compoundthiophosphoric acid estermonosaccharidepyrimidonethiophosphate monoesterorganic thiophosphoric acid or derivativessaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundprimary alcoholimidolactamalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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