| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:57:10 UTC |
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| Update Date | 2025-03-25 00:31:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02055356 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H7N3O |
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| Molecular Mass | 125.0589 |
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| SMILES | Cn1ncc(C=O)c1N |
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| InChI Key | NDGIYFSWJGZTRC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-aldehydes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrazolesvinylogous amides |
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| Substituents | vinylogous amidearomatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazoleorganic oxidearyl-aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganoheterocyclic compoundazole |
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