| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:22 UTC |
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| Update Date | 2025-03-25 00:45:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151972 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6N6O2 |
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| Molecular Mass | 194.0552 |
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| SMILES | NC(=O)c1nc(N)nc2[nH]c(=O)[nH]c12 |
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| InChI Key | VOVPPAFSMLDQHN-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 | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | purinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesamino acids and derivativesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic carbonic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminesprimary carboxylic acid amidespyrimidinecarboxylic acids and derivativesvinylogous amides |
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| Substituents | primary carboxylic acid amideamino acid or derivativescarboxylic acid derivative2-heteroaryl carboxamidepurinonepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundcarboxamide grouporganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundpyrimidine-6-carboxylic acid or derivativesamineorganooxygen compound |
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