| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:01 UTC |
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| Update Date | 2025-03-25 01:00:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02244802 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H10N2O3 |
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| Molecular Mass | 194.0691 |
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| SMILES | CN(C)C(=O)c1cccc([N+](=O)[O-])c1 |
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| InChI Key | DKWDGIRXGDSOST-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 | benzoic acids and derivatives |
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| Direct Parent | benzamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | benzoyl derivativescarboxylic acids and derivativeshydrocarbon derivativesnitroaromatic compoundsnitrobenzenesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundstertiary carboxylic acid amides |
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| Substituents | allyl-type 1,3-dipolar organic compoundbenzoylcarboxylic acid derivativebenzamideorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidec-nitro compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundorganic oxoazaniumnitrobenzenenitroaromatic compoundorganic 1,3-dipolar compoundcarboxamide grouparomatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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