| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:49 UTC |
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| Update Date | 2025-03-25 00:53:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200878 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H13NO4 |
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| Molecular Mass | 283.0845 |
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| SMILES | COc1ccc2c(c1)c(=O)oc1ccc(NC(C)=O)cc12 |
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| InChI Key | OWQOCVOKQXSNEX-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-benzopyrans2-benzopyransacetamidesalkyl aryl ethersanisolescarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesisocoumarins and derivativeslactonesn-acetylarylaminesorganic oxidesorganopnictogen compoundsoxacyclic compoundspyranones and derivativessecondary carboxylic acid amides |
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| Substituents | phenol ethercarbonyl groupethern-acetylarylamine1-benzopyrann-arylamidealkyl aryl ethercarboxylic acid derivativelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyranoneorganopnictogen compoundorganoheterocyclic compoundacetamidebenzopyranheteroaromatic compoundcarboxamide groupisocoumarincoumarinoxacyclesecondary carboxylic acid amideorganic oxygen compoundpyrananisole2-benzopyranhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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