| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:05:56 UTC |
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| Update Date | 2025-03-21 22:09:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00499429 |
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| Frequency | 3.4 |
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| Structure | |
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| Chemical Formula | C6H8N2 |
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| Molecular Mass | 108.0687 |
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| SMILES | CC=Cc1ccn[nH]1 |
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| InChI Key | PMCWUJVAHXMNRL-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 | 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 derivativesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrazole |
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