| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:46 UTC |
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| Update Date | 2025-03-21 18:03:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00047614 |
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| Frequency | 69.9 |
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| Structure | |
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| Chemical Formula | C6H9N5O |
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| Molecular Mass | 167.0807 |
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| SMILES | CNc1ncnc(N)c1NC=O |
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| InChI Key | SAYNWDGJCVXNNP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | n-arylamides |
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| Direct Parent | n-arylamides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivativessecondary alkylarylaminessecondary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleamino acid or derivativesheteroaromatic compoundn-arylamidesecondary aminecarboxamide groupcarboxylic acid derivativesecondary aliphatic/aromatic aminepyrimidinesecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineimidolactamamineorganoheterocyclic compoundorganooxygen compound |
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