| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:09 UTC |
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| Update Date | 2025-03-25 00:48:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02169631 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H19N3O9P2S |
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| Molecular Mass | 431.0317 |
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| SMILES | CCOP(O)(=S)OP(=O)(O)OCC1OC(n2ccc(N)nc2=O)CC1O |
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| InChI Key | HOJUZJXNOWAMNF-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 deoxyribonucleotides |
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| Direct Parent | pyrimidine 2'-deoxyribonucleoside monophosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary aminespyrimidonessecondary alcoholstetrahydrofuransthiophosphoric acid esters |
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| Substituents | aromatic heteromonocyclic compoundpentose phosphatethiophosphoric acid estermonosaccharidepyrimidonepyrimidineorganic thiophosphoric acid or derivativespyrimidine 2'-deoxyribonucleoside monophosphatesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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