| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:55:59 UTC |
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| Update Date | 2025-03-21 18:53:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00194926 |
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| Frequency | 11.6 |
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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=Nc2ccccc2C1 |
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| InChI Key | OKISVAYIVBWMDU-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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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 | ketimineazacycleindoleimineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compound |
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