| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:51 UTC |
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| Update Date | 2025-03-25 00:59:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235283 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8N2O4 |
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| Molecular Mass | 196.0484 |
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| SMILES | O=[N+]([O-])C=C(O)Nc1ccccc1O |
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| InChI Key | NVOMGPZBFIMTEU-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 homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkanolaminesbenzene and substituted derivativesc-nitro compoundshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | monocyclic benzene moietyallyl-type 1,3-dipolar organic compound1-hydroxy-2-unsubstituted benzenoidorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidec-nitro compoundorganopnictogen compoundorganic oxoazaniumalkanolamineorganic 1,3-dipolar compound1-hydroxy-4-unsubstituted benzenoidsecondary aliphatic/aromatic aminearomatic homomonocyclic compoundorganic oxygen compoundphenolhydrocarbon derivativebenzenoidorganooxygen compoundorganic hyponitrite |
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