| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:42 UTC |
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| Update Date | 2025-03-21 18:01:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00030605 |
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| Frequency | 121.4 |
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| Structure | |
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| Chemical Formula | C11H5Cl9O |
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| Molecular Mass | 467.7537 |
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| SMILES | ClC1=C(Cl)C2(Cl)C3C4OC4(Cl)C(Cl)C(Cl)C3C1(Cl)C2(Cl)Cl |
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| InChI Key | NQNBKIYCAWTMLK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | oxepanes |
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| Subclass | oxepanes |
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| Direct Parent | oxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | alkyl chlorideschloroalkenesdialkyl ethersepoxideshydrocarbon derivativesorganochloridesoxacyclic compoundsvinyl chlorides |
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| Substituents | etheralkyl chloridechloroalkeneorganochlorideoxiraneorganohalogen compounddialkyl etheraliphatic heteropolycyclic compoundoxepaneoxacycleorganic oxygen compoundvinyl halidehaloalkenealkyl halidehydrocarbon derivativevinyl chlorideorganooxygen compound |
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