Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:49:56 UTC |
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Update Date | 2025-03-21 18:02:30 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00038399 |
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Frequency | 91.2 |
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Structure | |
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Chemical Formula | C13H8Cl10 |
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Molecular Mass | 513.7511 |
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SMILES | ClC1=C(Cl)C2(Cl)C3C4C(Cl)C(Cl)C(Cl)C4C(Cl)C3C1(Cl)C2(Cl)Cl |
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InChI Key | HIPZJJWZNBLKRK-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | lipids and lipid-like molecules |
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Class | prenol lipids |
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Subclass | sesquiterpenoids |
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Direct Parent | linear triquinanes |
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Geometric Descriptor | aliphatic homopolycyclic compounds |
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Alternative Parents | alkyl chlorideschloroalkeneshydrocarbon derivativesorganochloridessesquiterpenoidsvinyl chlorides |
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Substituents | alkyl chloridechloroalkeneorganochlorideorganohalogen compoundaliphatic homopolycyclic compoundvinyl halidehaloalkenelinear triquinane sesquiterpenoidalkyl halidehydrocarbon derivativevinyl chloride |
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