| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:19 UTC |
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| Update Date | 2025-03-25 00:46:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158680 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H9N3O |
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| Molecular Mass | 139.0746 |
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| SMILES | OC1CNc2nccn2C1 |
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| InChI Key | MSVWUAIYPLBKKW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | secondary alkylarylamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesorganopnictogen compoundssecondary alcohols |
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| Substituents | alcoholazacycleheteroaromatic compoundsecondary aliphatic/aromatic amineorganic oxygen compoundaromatic heteropolycyclic compoundimidazolesecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compoundazolen-substituted imidazole |
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