| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:13 UTC |
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| Update Date | 2025-03-25 00:53:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201746 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17NO |
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| Molecular Mass | 191.131 |
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| SMILES | Cc1ccc(C(C)(C)C)cc1C(N)=O |
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| InChI Key | TZSQAXOMCJOMRC-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 derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenylpropanesprimary carboxylic acid amideso-toluamides |
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| Substituents | primary carboxylic acid amidebenzoylcarboxamide groupcarboxylic acid derivativetoluamidebenzamidephenylpropanearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundo-toluamideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundtolueneorganooxygen compound |
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