| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:25:25 UTC |
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| Update Date | 2025-03-24 20:44:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01551521 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H3N3 |
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| Molecular Mass | 105.0327 |
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| SMILES | N#Cc1ccncn1 |
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| InChI Key | ZIEWSZYVEDTXGH-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 | 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 derivativesnitrilesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | nitrilearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrilepyrimidine |
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