| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:30 UTC |
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| Update Date | 2025-03-25 00:46:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02156929 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H9ClO |
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| Molecular Mass | 180.0342 |
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| SMILES | C=CC(=O)Cc1ccccc1Cl |
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| InChI Key | DQSHVFFTOOLVEO-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 | acryloyl compoundsaryl chloridesenoneshydrocarbon derivativesketonesorganic oxidesorganochlorides |
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| Substituents | aryl chloridechlorobenzenecarbonyl grouporganochloridealpha,beta-unsaturated ketoneorganohalogen compoundaryl halideketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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