| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:33:15 UTC |
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| Update Date | 2025-03-24 17:52:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00994309 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C9H5NO |
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| Molecular Mass | 143.0371 |
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| SMILES | N#Cc1coc2ccccc12 |
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| InChI Key | VLLADTXGBAUFMW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzofurans |
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| Subclass | benzofurans |
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| Direct Parent | benzofurans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzenoidsfuransheteroaromatic compoundshydrocarbon derivativesnitrilesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | furannitrilebenzofuranheteroaromatic compoundoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundcarbonitrileorganooxygen compound |
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