| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:19 UTC |
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| Update Date | 2025-03-21 18:38:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123095 |
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| Frequency | 21.0 |
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| Structure | |
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| Chemical Formula | C12H14N2 |
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| Molecular Mass | 186.1157 |
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| SMILES | CC1NCCc2c1[nH]c1ccccc21 |
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| InChI Key | LPIJOZBIVDCQTE-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 | azacyclic compoundsbenzenoidsbeta carbolinesdialkylaminesheteroaromatic compoundshydrocarbon derivativesindolesorganopnictogen compoundspyrroles |
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| Substituents | secondary aliphatic amineazacycleindoleheteroaromatic compoundharmanindole or derivativessecondary aminearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundbeta-carbolinehydrocarbon derivativebenzenoidorganic nitrogen compoundorganoheterocyclic compoundpyridoindoleamine |
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