Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:56:54 UTC |
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Update Date | 2025-03-21 18:05:07 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00054821 |
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Frequency | 98.2 |
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Structure | |
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Chemical Formula | C9H14N2O11P2S |
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Molecular Mass | 419.9794 |
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SMILES | O=c1ccn(C2OC(COP(=O)(O)OP(O)(O)=S)C(O)C2O)c(=O)[nH]1 |
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InChI Key | HFPQTPQWHHTLHT-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | nucleosides, nucleotides, and analogues |
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Class | pyrimidine nucleotides |
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Subclass | pyrimidine ribonucleotides |
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Direct Parent | pyrimidine ribonucleoside monophosphates |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 1,2-diolsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganic thiophosphoric acids and derivativesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspentose phosphatespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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Substituents | lactamaromatic heteromonocyclic compoundpentose phosphatemonosaccharidepentose-5-phosphatepyrimidonepyrimidineorganic thiophosphoric acid or derivativessaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compound1,2-diolalcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacyclepyrimidine ribonucleoside monophosphateorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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