| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:08 UTC |
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| Update Date | 2025-03-25 00:45:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151443 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H12N4O4 |
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| Molecular Mass | 276.0859 |
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| SMILES | N#Cc1cc2cncnc2n1C1OC(CO)C(O)C1O |
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| InChI Key | DQNCWVDFOGIERK-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 | pyrrolopyrimidine nucleosides and nucleotides |
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| Subclass | pyrrolopyrimidine nucleosides and nucleotides |
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| Direct Parent | pyrrolopyrimidine nucleosides and nucleotides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonosaccharidesnitrilesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrimidines and pyrimidine derivativespyrrolo[2,3-d]pyrimidinessecondary alcoholssubstituted pyrrolestetrahydrofurans |
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| Substituents | nitrilemonosaccharidesubstituted pyrrolepyrimidinepyrrolopyrimidinesaccharidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholcarbonitrileorganoheterocyclic compoundalcoholazacycletetrahydrofuranheteroaromatic compoundpyrrolopyrimidine ribonucleosideoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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