| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:05 UTC |
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| Update Date | 2025-03-25 00:49:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02174094 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C26H36O4 |
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| Molecular Mass | 412.2614 |
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| SMILES | CCCCCC=CCC=CCC=CCCCCCC(=O)c1cccc(O)c1C(=O)O |
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| InChI Key | DGORASWRXFOVOP-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 homomonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl alkyl ketonesbenzoic acidsbenzoyl derivativesbutyrophenoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundssalicylic acidsvinylogous acids |
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| Substituents | monocyclic benzene moietycarboxylic acidaryl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidsalicylic acidcarboxylic acid derivativeorganic oxide1-carboxy-2-haloaromatic compoundbenzoic acidbenzoic acid or derivatives1-hydroxy-4-unsubstituted benzenoidhydroxybenzoic acidbutyrophenonearomatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativessalicylic acid or derivativesphenolhydrocarbon derivativebenzenoidalkyl-phenylketone |
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