CHEBI:10576 - (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene

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ChEBI Name (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene ChEBI ID CHEBI:10576 ChEBI ASCII Name (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene Definition A chlorocyclohexene that is cyclohexene which carries 5 chlorines at positions 1,3,4,5 and 6, respectively. It has (3R,4S,5S,6R) configuration. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H5Cl5 Net Charge 0 Average Mass 254.369 Monoisotopic Mass 251.88339 InChI InChI=1S/C6H5Cl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1-2,4-6H/t2-,4+,5+,6+/m1/s1 InChIKey MQYAVRUCONBHOR-JSTMLOLSSA-N SMILES [C@@H]1([C@H]([C@@H](C=C([C@@H]1Cl)Cl)Cl)Cl)Cl ChEBI Ontology Outgoing (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:10576) is a chlorocyclohexene (CHEBI:23139) (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:10576) is enantiomer of (3S,4R,5R,6S)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:142493) Incoming rac-γ-pentachlorocyclohexene (CHEBI:142492) has part (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:10576) (3S,4R,5R,6S)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:142493) is enantiomer of (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene (CHEBI:10576) IUPAC Name (3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene Synonyms Sources (1,3R,4S,5S,6R)-pentachlorocyclohexene ChEBI (3R,4S,5S,6R)-pentachlorocyclohexene UniProt 1,3(R),4(S),5(S),6(R)-PCCH ChEBI 3(R),4(S),5(S),6(R)-PCCH ChEBI Citations Types Sources 11099497 PubMed citation Europe PMC 1712426 PubMed citation Europe PMC Last Modified 02 November 2018