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compound 0094933

PropertiesImage
MNX_IDMNXM1180337 Image of MNXM1180337
referenceenvipathM:...50eacfbe0713
formulaC12H10Cl4O5
global charge0
mol weight376.019
InChIKeyZWSPZDGOVNMHAV-UHFFFAOYSA-N
InChIInChI=1S/C12H10Cl4O5/c13-6-4-8(19)5(12(16,9(4)14)10(6)15)2-1-3(17)21-11(20)7(2)18/h2-5,7,9,17-18H,1H2
SMILESO=C1OC(O)CC(C2C(=O)C3C(Cl)=C(Cl)C2(Cl)C3Cl)C1O
MNX internals
InChI (mnx)InChI=1/C12H10Cl4O5/c13-6-4-8(19)5(12(16,9(4)14)10(6)15)2-1-3(17)21-11(20)7(2)18/h2-5,7,9,17-18H,1H2/t2?,3?,4?,5?,7?,9?,12? Image of MNXM1180337
SMILES (mnx)[CH2:1]1[CH:2]([CH:5]2[C:8](=[O:19])[CH:4]3[C:6]([Cl:13])=[C:10]([Cl:15])[C:12]2([Cl:16])[CH:9]3[Cl:14])[CH:7]([OH:18])[C:11](=[O:20])[O:21][CH:3]1[OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

envipath:...50eacfbe0713
envipathM:...50eacfbe0713
ZWSPZDGOVNMHAV-UHFFFAOYSA-N
compound 0094933