| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:33:37 UTC |
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| Update Date | 2025-03-24 14:28:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00851676 |
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| Frequency | 1.7 |
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| Structure | |
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| Chemical Formula | C8H10NO+ |
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| Molecular Mass | 136.0757 |
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| SMILES | Cc1cccc([N+](C)=O)c1 |
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| InChI Key | PMVVSIINVNLCPB-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 | toluenes |
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| Direct Parent | toluenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminoxideshydrocarbon derivativesorganic cationsorganic oxidesorganic oxoazanium compoundsorganopnictogen compounds |
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| Substituents | aromatic homomonocyclic compoundorganic oxideorganic oxygen compoundaminoxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic oxoazaniumtoluene |
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