| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:40 UTC |
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| Update Date | 2025-03-25 01:01:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246358 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C28H34O8 |
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| Molecular Mass | 498.2254 |
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| SMILES | CC1=C(CCC(=O)O)C(=Cc2cc(C)c(CCC(=O)O)c(C)c2CCC(=O)O)C(CCC(=O)O)=C1C |
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| InChI Key | JWFOHESKYWFGOT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | tetracarboxylic acids and derivatives |
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| Direct Parent | tetracarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesorganic oxidesphenylpropanoic acidsm-xylenes |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acid3-phenylpropanoic-acidm-xylenetetracarboxylic acid or derivativesaromatic homomonocyclic compoundxyleneorganic oxideorganic oxygen compoundhydrocarbon derivativebenzenoidorganooxygen compound |
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