| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:33:58 UTC |
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| Update Date | 2025-03-21 22:50:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00565909 |
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| Frequency | 2.9 |
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| Structure | |
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| Chemical Formula | C5H5ClN2O |
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| Molecular Mass | 144.009 |
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| SMILES | NC(=O)c1cc(Cl)c[nH]1 |
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| InChI Key | QVAZLEBTIBKKBN-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 | pyrroles |
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| Subclass | pyrrole carboxylic acids and derivatives |
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| Direct Parent | pyrrole carboxamides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesaryl chloridesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsprimary carboxylic acid amides |
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| Substituents | aryl chlorideprimary carboxylic acid amidearomatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeorganohalogen compound2-heteroaryl carboxamidearyl halideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepyrrole-2-carboxamideorganic nitrogen compoundorganooxygen compound |
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