| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:05 UTC |
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| Update Date | 2025-03-21 18:02:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038757 |
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| Frequency | 90.2 |
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| Structure | |
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| Chemical Formula | C12H15ClO |
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| Molecular Mass | 210.0811 |
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| SMILES | OC1(c2ccc(Cl)cc2)CCCCC1 |
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| InChI Key | WSXSGCNVGCTIIZ-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 | aryl chloridescyclic alcohols and derivativescyclohexanolshydrocarbon derivativesorganochloridestertiary alcohols |
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| Substituents | aryl chloridechlorobenzenealcoholorganochloridecyclohexanolcyclic alcoholorganohalogen compoundaryl halidearomatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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