| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:22 UTC |
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| Update Date | 2025-03-21 18:28:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00070201 |
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| Frequency | 42.9 |
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| Structure | |
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| Chemical Formula | C13H12N2 |
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| Molecular Mass | 196.1 |
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| SMILES | Cc1ccc2c(c1)[nH]c1c(C)nccc12 |
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| InChI Key | IGWSJKQTVMTNDK-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 | 2-halopyridinesazacyclic compoundsbenzenoidsbeta carbolinesheteroaromatic compoundshydrocarbon derivativesindolesmethylpyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyrroles |
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| Substituents | azacycleindolepolyhalopyridineheteroaromatic compoundharmanindole or derivativesmethylpyridinepyridinearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundbeta-carbolinehydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganoheterocyclic compoundpyridoindole |
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