| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:32:45 UTC |
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| Update Date | 2025-03-21 21:51:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00420801 |
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| Frequency | 4.3 |
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| Structure | |
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| Chemical Formula | C9H9N |
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| Molecular Mass | 131.0735 |
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| SMILES | CC1=NCc2ccccc21 |
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| InChI Key | UJIRJKFRYZKGRD-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 | isoindoles and derivatives |
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| Subclass | isoindoles |
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| Direct Parent | isoindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidshydrocarbon derivativesketiminesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | ketimineazacycleimineisoindoleorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compound |
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