| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:43:36 UTC |
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| Update Date | 2025-03-21 17:59:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00023348 |
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| Frequency | 168.5 |
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| Structure | |
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| Chemical Formula | C12H10N2O |
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| Molecular Mass | 198.0793 |
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| SMILES | Cc1nccc2c1[nH]c1ccc(O)cc12 |
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| InChI Key | QMMOFTKCULGVPS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | harmala alkaloids |
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| Subclass | harmala alkaloids |
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| Direct Parent | harmala alkaloids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesazacyclic compoundsbenzenoidsbeta carbolinesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesindolesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyrroles |
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| Substituents | azacycleindolepolyhalopyridineheteroaromatic compoundhydroxypyridineharman1-hydroxy-2-unsubstituted benzenoidindole or derivativespyridineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundbeta-carbolinehydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundpyridoindole |
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