| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:05 UTC |
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| Update Date | 2025-03-21 17:58:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00013367 |
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| Frequency | 343.2 |
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| Structure | |
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| Chemical Formula | C9H12N2O11P2 |
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| Molecular Mass | 385.9916 |
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| SMILES | O=c1ccn(C2OC(COP(=O)(O)O)C3OP(=O)(O)OC32)c(=O)[nH]1 |
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| InChI Key | PXHRDNPZBBFFEO-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 | cyclic pyrimidine nucleotides |
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| Direct Parent | 2',3'-cyclic pyrimidine nucleotides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdioxaphospholanesheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkyl phosphatesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspentose phosphatespyrimidonesribonucleoside 3'-phosphatestetrahydrofuransvinylogous amides |
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| Substituents | lactampentose phosphatepyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundribonucleoside 3'-phosphatevinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compound1,3_dioxaphospholane2',3'-cyclic pyrimidine ribonucleotideoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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