Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:49:15 UTC |
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Update Date | 2025-03-25 00:49:48 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02176778 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H16O4 |
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Molecular Mass | 272.1049 |
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SMILES | CCCc1ccc(C(=O)c2c(O)cc(O)cc2O)cc1 |
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InChI Key | VGXQFOWAWLPJCF-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 | benzophenones |
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Direct Parent | benzophenones |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl ketonesaryl-phenylketonesbenzoyl derivativesdiphenylmethaneshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenylpropanesphloroglucinols and derivativesvinylogous acids |
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Substituents | diphenylmethanebenzenetriolaryl-phenylketonebenzoyl1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidbenzophenoneketonephenylpropanephloroglucinol derivativearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundphenolhydrocarbon derivativeorganooxygen compoundaryl ketone |
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