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7Z8

Summary
Name:N-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentakis(oxidanyl)hexyl]nonanamide
Synonyms:MEGA-9
Formula:C16 H33 N O6
Formal charge:0
Formula weight:335.436 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-methyl-~{N}-[(2~{S},3~{R},4~{R},5~{R})-2,3,4,5,6-pentakis(oxidanyl)hexyl]nonanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C16H33NO6/c1-3-4-5-6-7-8-9-14(21)17(2)10-12(19)15(22)16(23)13(20)11-18/h12-13,15-16,18-20,22-23H,3-11H2,1-2H3/t12-,13+,15+,16+/m0/s1
InChIKeyInChI1.06GCRLIVCNZWDCDE-SJXGUFTOSA-N
SMILES_CANONICALCACTVS3.385CCCCCCCCC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
SMILESCACTVS3.385CCCCCCCCC(=O)N(C)C[CH](O)[CH](O)[CH](O)[CH](O)CO
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCCCCCC(=O)N(C)C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
SMILESOpenEye OEToolkits2.0.7CCCCCCCCC(=O)N(C)CC(C(C(C(CO)O)O)O)O

222415

건을2024-07-10부터공개중

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