| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:56 UTC |
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| Update Date | 2025-03-21 18:36:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00110181 |
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| Frequency | 24.2 |
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| Structure | |
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| Chemical Formula | C11H8O5 |
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| Molecular Mass | 220.0372 |
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| SMILES | COc1ccc2cc(C(=O)O)c(=O)oc2c1 |
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| InChI Key | VEEGNDSSWAOLFN-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-benzopyransalkyl aryl ethersanisolescarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundspyranones and derivatives |
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| Substituents | phenol etheretherbenzopyrancarboxylic acid1-benzopyranheteroaromatic compoundalkyl aryl ethercarboxylic acid derivativecoumarinlactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrananisolepyranonehydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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