| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:39 UTC |
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| Update Date | 2025-03-21 18:01:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00035278 |
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| Frequency | 106.6 |
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| Structure | |
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| Chemical Formula | C7H7N3O2 |
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| Molecular Mass | 165.0538 |
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| SMILES | Cn1ccc2c(=O)[nH]c(=O)[nH]c21 |
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| InChI Key | NKCKSKFBUCXXMA-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 | pyrrolopyrimidines |
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| Subclass | pyrrolo[2,3-d]pyrimidines |
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| Direct Parent | pyrrolo[2,3-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsn-methylpyrrolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonessubstituted pyrrolesvinylogous amides |
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| Substituents | vinylogous amiden-methylpyrrolecarbonic acid derivativelactamazacycleheteroaromatic compoundpyrimidonesubstituted pyrrolepyrimidineorganic oxidepyrrolo[2,3-d]pyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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