| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:51:31 UTC |
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| Update Date | 2025-03-21 18:03:05 UTC |
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| HMDB ID | HMDB0014738 |
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| Metabolite Identification |
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| DeepMet ID | DMID00042156 |
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| Name | Monobenzone |
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| Frequency | 81.2 |
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| Structure | |
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| Chemical Formula | C13H12O2 |
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| Molecular Mass | 200.0837 |
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| SMILES | Oc1ccc(OCc2ccccc2)cc1 |
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| InChI Key | VYQNWZOUAUKGHI-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 | phenols |
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| Subclass | 4-alkoxyphenols |
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| Direct Parent | 4-alkoxyphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethershydrocarbon derivativesphenol ethersphenoxy compounds |
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| Substituents | phenol ethermonocyclic benzene moiety4-alkoxyphenolether1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheraromatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativephenoxy compoundorganooxygen compound |
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