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YQ4

Summary
Name:(~{R})-phenyl-[4-[(tributyl-$l^{4}-azanyl)methyl]phenyl]methanol
Formula:C26 H40 N O
Formal charge:0
Formula weight:382.602 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(~{R})-phenyl-[4-[(tributyl-$l^{4}-azanyl)methyl]phenyl]methanol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C26H40NO/c1-4-7-19-27(20-8-5-2,21-9-6-3)22-23-15-17-25(18-16-23)26(28)24-13-11-10-12-14-24/h10-18,26,28H,4-9,19-22H2,1-3H3/t26-/m1/s1
InChIKeyInChI1.03DQUWSYFZBXCPSD-AREMUKBSSA-N
SMILES_CANONICALCACTVS3.385CCCC[N](CCCC)(CCCC)Cc1ccc(cc1)[C@H](O)c2ccccc2
SMILESCACTVS3.385CCCC[N](CCCC)(CCCC)Cc1ccc(cc1)[CH](O)c2ccccc2
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCC[N](CCCC)(CCCC)Cc1ccc(cc1)[C@@H](c2ccccc2)O
SMILESOpenEye OEToolkits2.0.7CCCC[N](CCCC)(CCCC)Cc1ccc(cc1)C(c2ccccc2)O

223532

PDB entries from 2024-08-07

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