| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:47 UTC |
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| Update Date | 2025-03-25 00:51:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189436 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H16O4 |
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| Molecular Mass | 284.1049 |
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| SMILES | CC(C)c1ccc(OC(=O)c2ccccc2C(=O)O)cc1 |
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| InChI Key | MPYWPTKSAZAESN-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 | depsides and depsidones |
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| Subclass | depsides and depsidones |
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| Direct Parent | depsides and depsidones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsbenzoic acid estersbenzoic acidsbenzoyl derivativescarboxylic acid esterscumenesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenol estersphenoxy compoundsphenylpropanes |
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| Substituents | monocyclic benzene moietycarboxylic acidbenzoylbenzoic acid or derivativesbenzoate estercarboxylic acid derivativephenylpropanearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundcarboxylic acid esterphenol esterdicarboxylic acid or derivativescumenehydrocarbon derivativebenzenoid1-carboxy-2-haloaromatic compoundbenzoic acidphenoxy compoundorganooxygen compounddepside backbone |
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