| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:21 UTC |
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| Update Date | 2025-03-21 17:59:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00018313 |
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| Frequency | 233.5 |
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| Structure | |
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| Chemical Formula | C6H5N5O2 |
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| Molecular Mass | 179.0443 |
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| SMILES | Nc1nc(=O)c(=O)c2[nH]cnc2[nH]1 |
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| InChI Key | HTCFDEKQBMQXNE-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 | imidazodiazepines |
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| Subclass | imidazodiazepines |
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| Direct Parent | imidazodiazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-diazepinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminesvinylogous amides |
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| Substituents | meta-diazepinevinylogous amideazacycleheteroaromatic compoundimidazo-meta-diazepineimidazodiazepineorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compoundazole |
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