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F9T

Summary
Name:6-[4-(4-hexyl-2-oxidanyl-phenoxy)phenoxy]pyridin-2-ol
Formula:C23 H25 N O4
Formal charge:0
Formula weight:379.449 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.66-[4-(4-hexyl-2-oxidanyl-phenoxy)phenoxy]pyridin-2-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C23H25NO4/c1-2-3-4-5-7-17-10-15-21(20(25)16-17)27-18-11-13-19(14-12-18)28-23-9-6-8-22(26)24-23/h6,8-16,25H,2-5,7H2,1H3,(H,24,26)
InChIKeyInChI1.03RNLVXOQANIRULJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCCCc1ccc(Oc2ccc(Oc3cccc(O)n3)cc2)c(O)c1
SMILESCACTVS3.385CCCCCCc1ccc(Oc2ccc(Oc3cccc(O)n3)cc2)c(O)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6CCCCCCc1ccc(c(c1)O)Oc2ccc(cc2)Oc3cccc(n3)O
SMILESOpenEye OEToolkits2.0.6CCCCCCc1ccc(c(c1)O)Oc2ccc(cc2)Oc3cccc(n3)O

223790

PDB entries from 2024-08-14

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