| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:31:09 UTC |
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| Update Date | 2025-03-24 14:27:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00845694 |
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| Frequency | 1.7 |
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| Structure | |
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| Chemical Formula | C8H12N2 |
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| Molecular Mass | 136.1 |
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| SMILES | Cc1ccc(C(C)C)nn1 |
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| InChI Key | BFIWVLLBFVANRS-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 | pyridazines and derivatives |
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| Direct Parent | pyridazines and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacyclepyridazineheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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