| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:12:07 UTC |
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| Update Date | 2025-03-25 00:36:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02090807 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C6H9N3 |
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| Molecular Mass | 123.0796 |
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| SMILES | C=Cc1nc[nH]c1CN |
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| InChI Key | XHQIOZZHVZJCLO-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | imidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleimidazoleheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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