| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:55:56 UTC |
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| Update Date | 2025-03-21 18:04:46 UTC |
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| HMDB ID | HMDB0032944 |
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| Metabolite Identification |
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| DeepMet ID | DMID00052652 |
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| Name | Coumarin-4-carboxylic acid |
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| Frequency | 61.7 |
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| Structure | |
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| Chemical Formula | C10H6O4 |
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| Molecular Mass | 190.0266 |
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| SMILES | O=C(O)c1cc(=O)oc2ccccc12 |
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| InChI Key | DORZTUIRBJRLFD-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 | coumarins and derivatives |
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| Subclass | coumarins and derivatives |
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| Direct Parent | coumarins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-carboxy-2-haloaromatic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsoxacyclic compoundspyranones and derivatives |
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| Substituents | benzopyrancarboxylic acid1-benzopyranheteroaromatic compoundcarboxylic acid derivativecoumarinlactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyranpyranonehydrocarbon derivativebenzenoid1-carboxy-2-haloaromatic compoundorganoheterocyclic compoundorganooxygen compound |
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