MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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1-chloro-2,2-bis(4'-chlorophenyl)ethylene

	Properties	Image
MNX_ID	MNXM3781
reference	chebi:27454
formula	C₁₄H₉Cl₃
global charge	0
mol weight	283.585
InChIKey	LNKQQZFLNUVWQQ-UHFFFAOYSA-N
InChI	InChI=1S/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H
SMILES	ClC=C(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1

MNX internals

InChI (mnx)	InChI=1/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H
SMILES (mnx)	[CH:1]1=[CH:5][C:12]([Cl:16])=[CH:6][CH:2]=[C:10]1[C:14](=[CH:9][Cl:15])[C:11]1=[CH:4][CH:8]=[C:13]([Cl:17])[CH:7]=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27454 chebi:27454 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	1-chloro-2,2-bis(4'-chlorophenyl)ethylene 1,1-Bis(p-chlorophenyl)-2-chloroethene 1,1-Bis(p-chlorophenyl)-2-chloroethylene 1,1-bis(4-chlorophenyl)-2-chloroethylene 1-Chloro-2,2-bis(4'-chlorophenyl)ethylene 1-Chloro-2,2-bis(p-chlorophenyl)ethylene 2,2-Bis(4-chlorophenyl)-1-chloroethylene 2,2-Bis(p-chlorophenyl)-1-chloroethylene 4,4'-DDMU DDMU
hmdb:HMDB0250897 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	1,1-Bis(p-chlorophenyl)-2-chloroethene 1,1-Bis(4-chlorophenyl)-2-chloroethylene 1,1-Bis(p-chlorophenyl)-2-chloroethylene 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethylene 1-Chloro-2,2-bis(p-chlorophenyl)ethylene 1-chloro-4-[2-chloro-1-(4-chlorophenyl)ethenyl]benzene 2,2-Bis(4-chlorophenyl)-1-chloroethylene 2,2-Bis(p-chlorophenyl)-1-chloroethylene 4,4'-DDMU DDE DDMU DDX Dichlorodiphenyl dichloroethylene Dichloroethylene, dichlorodiphenyl TDEE p,P'-dde p,p-Dichlorodiphenyldichloroethylene
kegg.compound:C06637 keggC:C06637 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	1-Chloro-2,2-bis(4'-chlorophenyl)ethylene DDMU
envipath:...03f1fad65c68 envipathM:...03f1fad65c68 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	1-Chloro-2,2-bis(4`-chlorophenyl)ethylene (DDMU)
seed.compound:cpd04041 seedM:cpd04041 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	DDMU 1-Chloro-2,2-bis(4'-chlorophenyl)ethylene
envipath:...4202882072bb envipathM:...4202882072bb LNKQQZFLNUVWQQ-UHFFFAOYSA-N	compound 0054762
envipath:...d7f7ff67d245 envipathM:...d7f7ff67d245 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	compound 0054763
envipath:...e9eb86d96008 envipathM:...e9eb86d96008 LNKQQZFLNUVWQQ-UHFFFAOYSA-N	compound 0054765
chebi:19035 chebi:619 keggC:M_C06637 seedM:M_cpd04041	secondary/obsolete/fantasy identifier