| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:05 UTC |
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| Update Date | 2025-03-25 00:57:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222360 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H12N2O |
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| Molecular Mass | 236.095 |
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| SMILES | O=C1c2ccccc2NC2c3ccccc3NC12 |
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| InChI Key | LBSHPUKSUXLVDW-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 | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundsbenzenoidshydrocarbon derivativeshydroquinolineshydroquinolonesindolesindolinesorganic oxidesorganooxygen compoundsorganopnictogen compoundssecondary alkylarylaminesvinylogous amides |
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| Substituents | aryl alkyl ketoneindoleketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtetrahydroquinolinedihydroindoleindolecarboxylic acid derivativevinylogous amidequinolonetetrahydroquinoloneazacyclesecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compoundaryl ketone |
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