| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:52:04 UTC |
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| Update Date | 2025-03-25 00:29:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02043251 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H7N2O+ |
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| Molecular Mass | 111.0553 |
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| SMILES | CNc1ccnc[o+]1 |
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| InChI Key | XZBPYXBLYKVUOG-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 heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic cationsorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundsecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeorganic cationorganoheterocyclic compoundorganooxygen compound |
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