| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:55:44 UTC |
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| Update Date | 2025-03-21 22:01:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00475103 |
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| Frequency | 3.7 |
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| Structure | |
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| Chemical Formula | C3H6N4O |
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| Molecular Mass | 114.0542 |
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| SMILES | CNc1nc(=O)[nH][nH]1 |
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| InChI Key | KHJOQFFHWNZHHP-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 | amines |
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| Direct Parent | secondary alkylarylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundstriazoles |
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| Substituents | triazolecarbonic acid derivativearomatic heteromonocyclic compound1,2,4-triazoleazacycleheteroaromatic compoundsecondary aliphatic/aromatic amineorganic oxideorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compoundazole |
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