Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:50:01 UTC |
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Update Date | 2025-03-25 00:50:04 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02178584 |
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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 | Cc1cccc(O)c1C(C)C(=O)c1ccc(O)cc1O |
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InChI Key | ABHCXEWNNOHKKL-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | phenylpropanoids and polyketides |
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Class | alpha-methyldeoxybenzoin flavonoids |
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Subclass | alpha-methyldeoxybenzoin flavonoids |
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Direct Parent | alpha-methyldeoxybenzoin flavonoids |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl-phenylketonesaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesmeta cresolsorganic oxidesorganooxygen compoundsphenylpropanesresorcinolsstilbenestoluenesvinylogous acids |
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Substituents | monocyclic benzene moietyaryl alkyl ketonem-cresolbenzoyl1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidphenylketoneresorcinolalpha-methyldeoxybenzoin flavonoidketonephenylpropanearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundphenolhydrocarbon derivativebenzenoidtoluenealkyl-phenylketoneorganooxygen compoundaryl ketonestilbene |
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