| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:49:44 UTC |
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| Update Date | 2025-03-24 21:48:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01895202 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H7N3 |
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| Molecular Mass | 133.064 |
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| SMILES | Cc1cnc(C)c(C#N)n1 |
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| InChI Key | NCKKBZUIFHHRBY-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 | pyrazines |
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| Direct Parent | pyrazines |
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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 compoundazacyclepyrazineheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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