| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:44 UTC |
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| Update Date | 2025-03-25 00:49:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02175582 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H14O5 |
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| Molecular Mass | 262.0841 |
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| SMILES | O=C(C=Cc1ccc(O)cc1)OCC1CCC(=O)O1 |
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| InChI Key | UNPUQHOQQHSDEX-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 | cinnamic acids and derivatives |
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| Subclass | hydroxycinnamic acids and derivatives |
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| Direct Parent | hydroxycinnamic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsbenzene and substituted derivativescarbonyl compoundsdicarboxylic acids and derivativesenoate estersfatty acid estersgamma butyrolactoneshydrocarbon derivativesorganic oxidesoxacyclic compoundstetrahydrofurans |
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| Substituents | fatty acylmonocyclic benzene moietycarbonyl grouparomatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativelactonealpha,beta-unsaturated carboxylic esterorganic oxideorganoheterocyclic compoundenoate estertetrahydrofurangamma butyrolactonehydroxycinnamic acidoxacyclefatty acid esterorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativesphenolhydrocarbon derivativebenzenoidorganooxygen compound |
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