| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:39:44 UTC |
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| Update Date | 2025-03-21 18:48:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00156660 |
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| Frequency | 15.3 |
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| Structure | |
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| Chemical Formula | C7H7NO2 |
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| Molecular Mass | 137.0477 |
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| SMILES | O=NOCc1ccccc1 |
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| InChI Key | IYYGLLJDALWAMD-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 | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl nitriteshydrocarbon derivativesnitrite estersorganic o-nitroso compoundsorganic nitrogen compoundsorganic oxidesorganooxygen compounds |
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| Substituents | monocyclic benzene moietyorganic nitroso compoundorganic nitritealkyl nitritearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativenitrite esterorganic nitrogen compoundorganooxygen compoundorganic o-nitroso compound |
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