| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:26 UTC |
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| Update Date | 2025-03-25 00:52:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190866 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H13N5O2 |
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| Molecular Mass | 283.1069 |
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| SMILES | C=CC1=C(C)C(=O)NC1=Cc1c[nH]c2[nH]c(N)nc(=O)c12 |
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| InChI Key | ULKRBQZAVUTJFR-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 | amino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganopnictogen compoundsprimary aminespyrimidonespyrrolespyrrolinessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | carbonyl grouplactamamino acid or derivativespyrimidonecarboxylic acid derivativepyrimidineorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundvinylogous amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolinepyrrolehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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