| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:34:02 UTC |
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| Update Date | 2025-03-24 21:41:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01858331 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C4H6N4O |
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| Molecular Mass | 126.0542 |
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| SMILES | NC(=O)Nc1ccn[nH]1 |
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| InChI Key | XAEGRAIWWBXIRR-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 compoundscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | carbonyl groupcarbonic acid derivativearomatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrazoleorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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