| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:25 UTC |
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| Update Date | 2025-03-25 00:57:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225338 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H12O4 |
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| Molecular Mass | 232.0736 |
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| SMILES | CC(C(=O)c1ccc(O)cc1O)c1ccoc1 |
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| InChI Key | XMCXJBIWRRBEAG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl alkyl ketonesbenzoyl derivativesfuransheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundsphenylpropanesresorcinolsvinylogous acids |
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| Substituents | furanmonocyclic benzene moietyaryl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundbenzoyl1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidresorcinolphenylpropaneoxacyclevinylogous acidorganic oxidephenolhydrocarbon derivativebenzenoidalkyl-phenylketoneorganoheterocyclic compound |
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