| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:50 UTC |
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| Update Date | 2025-03-21 18:37:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00117221 |
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| Frequency | 29.0 |
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| Structure | |
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| Chemical Formula | C12H11N3O |
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| Molecular Mass | 213.0902 |
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| SMILES | OC1=Nc2ccccc2C1Cc1cnc[nH]1 |
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| InChI Key | SAJDSBYEBUOVAN-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 | 3-alkylindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidscyclic carboximidic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | azacycleheteroaromatic compound3-alkylindoleorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundcyclic carboximidic acidorganooxygen compoundazole |
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