| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:08 UTC |
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| Update Date | 2025-03-25 00:50:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183341 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H11N3O |
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| Molecular Mass | 177.0902 |
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| SMILES | O=C(c1cncnc1)N1CCCC1 |
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| InChI Key | NZAOJYJHQNWSMB-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesn-acylpyrrolidinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundstertiary carboxylic acid amides |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundn-acylpyrrolidinepyrimidine-5-carboxylic acid or derivativescarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganooxygen compound |
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