| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:31:33 UTC |
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| Update Date | 2025-03-24 14:27:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00846671 |
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| Frequency | 1.7 |
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| Structure | |
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| Chemical Formula | C7H5NO |
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| Molecular Mass | 119.0371 |
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| SMILES | [O-][N+]1=Cc2ccccc21 |
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| InChI Key | BAPDOJQUCQEIAV-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 | Not Available |
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| Subclass | benzenoids |
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| Direct Parent | benzenoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | allyl-type 1,3-dipolar organic compoundsazacyclic compoundshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | azacycleallyl-type 1,3-dipolar organic compoundorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganoheterocyclic compoundorganic hyponitrite |
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