| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:45:32 UTC |
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| Update Date | 2025-03-24 20:27:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01455108 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C6H12N3+ |
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| Molecular Mass | 126.1026 |
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| SMILES | C[n+]1ccc(CCN)[nH]1 |
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| InChI Key | HVJSAASIIATSGA-UHFFFAOYSA-O |
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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 | pyrazoles |
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| Direct Parent | pyrazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic cationsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganic cation |
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