| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:25:11 UTC |
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| Update Date | 2025-03-21 22:18:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00545019 |
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| Frequency | 3.1 |
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| Structure | |
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| Chemical Formula | C3H3ClN2O |
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| Molecular Mass | 117.9934 |
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| SMILES | O=c1[nH]cc(Cl)[nH]1 |
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| InChI Key | KROZHNHKFAUKNE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | aryl halides |
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| Subclass | aryl chlorides |
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| Direct Parent | aryl chlorides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganic carbonic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridecarbonic acid derivativearomatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundorganic oxideorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundazole |
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