| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:44:30 UTC |
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| Update Date | 2025-03-21 20:01:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00306864 |
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| Frequency | 6.4 |
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| Structure | |
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| Chemical Formula | C5H8N3+ |
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| Molecular Mass | 110.0713 |
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| SMILES | C[n+]1ccc(N)nc1 |
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| InChI Key | XWNRDCPFRULYMM-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidines and pyrimidine derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic cationsorganopnictogen compoundsprimary amines |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrimidineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic cationimidolactamamine |
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