| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:54 UTC |
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| Update Date | 2025-03-25 00:50:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182835 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H9NO3 |
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| Molecular Mass | 263.0582 |
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| SMILES | O=c1[nH]c2c(=O)oc3ccccc3c2c2ccccc12 |
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| InChI Key | FVTTYQPNNXNDPE-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-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesisoquinolones and derivativeslactamslactonesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinespyranones and derivativespyridines and derivativespyridinones |
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| Substituents | lactam1-benzopyranpolyhalopyridinelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyranoneorganopnictogen compoundisoquinolone2-halopyridineorganoheterocyclic compoundbenzopyranazacycleheteroaromatic compoundcoumarinoxacyclepyridineorganic oxygen compoundpyranisoquinolinehydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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