| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:39:35 UTC |
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| Update Date | 2025-03-21 17:58:27 UTC |
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| HMDB ID | HMDB0253648 |
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| Metabolite Identification |
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| DeepMet ID | DMID00014501 |
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| Name | Isoindoline |
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| Frequency | 303.7 |
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| Structure | |
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| Chemical Formula | C8H9N |
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| Molecular Mass | 119.0735 |
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| SMILES | c1ccc2c(c1)CNC2 |
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| InChI Key | GWVMLCQWXVFZCN-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 compoundsbenzenoidsdialkylamineshydrocarbon derivativesisoindolinesorganopnictogen compounds |
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| Substituents | secondary aliphatic amineazacycleisoindolesecondary amineisoindolinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamine |
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