| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:08 UTC |
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| Update Date | 2025-03-21 18:33:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098387 |
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| Frequency | 28.0 |
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| Structure | |
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| Chemical Formula | C13H13N2+ |
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| Molecular Mass | 197.1073 |
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| SMILES | Cc1c2[nH]c3ccccc3c2cc[n+]1C |
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| InChI Key | WURQJRLLMSPUST-UHFFFAOYSA-O |
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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 derivativesindolesorganic cationsorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyrroles |
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| Substituents | azacycleindolepolyhalopyridineheteroaromatic compoundharmanindole or derivativespyridinearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundbeta-carbolinehydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganic cationorganoheterocyclic compoundpyridoindole |
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