| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:55 UTC |
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| Update Date | 2025-03-25 00:46:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153301 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H15NO4 |
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| Molecular Mass | 261.1001 |
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| SMILES | COc1ccc2c(CCNC(C)=O)cc(=O)oc2c1 |
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| InChI Key | CYYFXJVVTGTBOP-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-benzopyransacetamidesalkyl aryl ethersanisolescarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyranones and derivativessecondary carboxylic acid amides |
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| Substituents | phenol ethercarbonyl groupether1-benzopyranalkyl aryl ethercarboxylic acid derivativelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyranoneorganopnictogen compoundorganoheterocyclic compoundacetamidebenzopyranheteroaromatic compoundcarboxamide groupcoumarinoxacyclesecondary carboxylic acid amideorganic oxygen compoundpyrananisolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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