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(3R,4S,5S,6R)-pentachlorocyclohexene

PropertiesImage
MNX_IDMNXM5995 Image of MNXM5995
referencechebi:10576
formulaC6H5Cl5
global charge0
mol weight254.371
InChIKeyMQYAVRUCONBHOR-JSTMLOLSSA-N
InChIInChI=1S/C6H5Cl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1-2,4-6H/t2-,4+,5+,6+/m1/s1
SMILESClC1=C[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@H]1Cl
MNX internals
InChI (mnx)InChI=1/C6H5Cl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1-2,4-6H/t2-,4+,5+,6+/m1/s1 Image of MNXM5995
SMILES (mnx)[CH:1]1=[C:3]([Cl:8])[C@H:5]([Cl:10])[C@@H:6]([Cl:11])[C@@H:4]([Cl:9])[C@@H:2]1[Cl:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:10576
chebi:10576
MQYAVRUCONBHOR-JSTMLOLSSA-N 		(3R,4S,5S,6R)-pentachlorocyclohexene
(1,3R,4S,5S,6R)-pentachlorocyclohexene
(3R,4S,5S,6R)-1,3,4,5,6-pentachlorocyclohexene
1,3(R),4(S),5(S),6(R)-PCCH
3(R),4(S),5(S),6(R)-PCCH

envipath:...74b72a694581
envipathM:...74b72a694581
MQYAVRUCONBHOR-JSTMLOLSSA-N 		1,3(R),4(S),5(S),6(R)-Pentachlorocyclohexene

kegg.compound:C06596
keggC:C06596
MQYAVRUCONBHOR-JSTMLOLSSA-N 		gamma-Pentachlorocyclohexene

seed.compound:cpd04000
seedM:cpd04000
MQYAVRUCONBHOR-JSTMLOLSSA-N 		gamma-Pentachlorocyclohexene
gamma-PCCH
gamma-pentachlorocyclohexane
gamma-pentachlorocyclohexene

metacyc.compound:GAMMA-PENTACHLOROCYCLOHEXANE
metacycM:GAMMA-PENTACHLOROCYCLOHEXANE
MQYAVRUCONBHOR-JSTMLOLSSA-N 		gamma-pentachlorocyclohexene
gamma-PCCH
gamma-pentachlorocyclohexane

keggC:M_C06596
seedM:M_cpd04000 		secondary/obsolete/fantasy identifier