| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:17 UTC |
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| Update Date | 2025-03-25 00:51:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190541 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8ClNO |
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| Molecular Mass | 169.0294 |
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| SMILES | C=C(O)Nc1ccc(Cl)cc1 |
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| InChI Key | OVPYGTUFEINGDC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | chlorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkanolaminesaryl chlorideshydrocarbon derivativesorganochloridesorganooxygen compoundsorganopnictogen compoundssecondary alkylarylamines |
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| Substituents | aryl chloridechlorobenzeneorganochloridesecondary amineorganohalogen compoundsecondary aliphatic/aromatic aminearyl halidearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundaminealkanolamine |
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