| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:56 UTC |
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| Update Date | 2025-03-25 00:45:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150965 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16N4O3 |
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| Molecular Mass | 264.1222 |
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| SMILES | CC(=O)NCCc1c[nH]c2c1c(=O)n(C)c(=O)n2C |
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| InChI Key | KWPFKVUWMZRYQN-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 | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidonespyrrolessecondary carboxylic acid amidesureasvinylogous amides |
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| Substituents | carbonyl grouplactampyrimidonecarboxylic acid derivativepyrimidineureaorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundacetamidevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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