| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 12:43:12 UTC |
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| Update Date | 2025-03-24 21:45:17 UTC |
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| HMDB ID | HMDB0255196 |
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| Metabolite Identification |
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| DeepMet ID | DMID01879820 |
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| Name | N-Nitroaniline |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C6H6N2O2 |
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| Molecular Mass | 138.0429 |
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| SMILES | O=[N+]([O-])Nc1ccccc1 |
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| InChI Key | VBEGHXKAFSLLGE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | phenylhydrazines |
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| Direct Parent | phenylhydrazines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesnitraminesorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | allyl-type 1,3-dipolar organic compoundorganic 1,3-dipolar compoundorganic nitro compoundaromatic homomonocyclic compoundorganic oxidenitramineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundphenylhydrazineorganic hyponitrite |
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