| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:08 UTC |
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| Update Date | 2025-03-25 01:00:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242696 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H11NO |
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| Molecular Mass | 161.0841 |
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| SMILES | CC(=O)C(C)=Nc1ccccc1 |
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| InChI Key | VUKHLRCFXHPRFN-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 | hydrocarbon derivativesketonesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary ketimines |
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| Substituents | ketiminemonocyclic benzene moietycarbonyl groupimineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundketonearomatic homomonocyclic compoundsecondary ketimineorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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