| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:55:35 UTC |
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| Update Date | 2025-03-21 18:04:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00051838 |
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| Frequency | 62.9 |
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| Structure | |
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| Chemical Formula | C13H17N5O3 |
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| Molecular Mass | 291.1331 |
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| SMILES | Cn1c(=N)[nH]c(=O)c2c(CNC3C=CC(O)C3O)c[nH]c21 |
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| InChI Key | HIQHZRCDKQRWFI-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 | 1,2-diolsazacyclic compoundsdialkylaminesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganopnictogen compoundspyrimidonespyrrolessecondary alcoholsvinylogous amides |
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| Substituents | lactampyrimidonepyrimidineorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1,2-diolalcoholvinylogous amidesecondary aliphatic amineazacycleheteroaromatic compoundsecondary amineorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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