| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:42:45 UTC |
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| Update Date | 2025-03-24 21:45:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01878744 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H6N2 |
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| Molecular Mass | 118.0531 |
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| SMILES | C1=Cc2ccc([nH]2)C=N1 |
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| InChI Key | KNJBMJWDPDMNBO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundshydrocarbon derivativesiminesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrroles |
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| Substituents | azacycleimineheteroaromatic compoundorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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