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N-Acetyl-(N,0-permethyl)-alanyl-prolyl-leucyl-phenylalanyl-valyl-glycine
SpectraBase Compound ID 4hiiqXIquVN
InChI InChI=1S/C38H60N6O8/c1-24(2)21-30(41(9)35(48)29-19-16-20-44(29)34(47)26(5)40(8)27(6)45)36(49)42(10)31(22-28-17-14-13-15-18-28)37(50)43(11)33(25(3)4)38(51)39(7)23-32(46)52-12/h13-15,17-18,24-26,29-31,33H,16,19-23H2,1-12H3
InChIKey WHCWPQBPOIKJSW-UHFFFAOYSA-N
Mol Weight 728.9 g/mol
Molecular Formula C38H60N6O8
Exact Mass 728.447263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMgfoAIjLTa
Name N-Acetyl-(N,0-permethyl)-alanyl-prolyl-leucyl-phenylalanyl-valyl-glycine
Alternate Name(s) Methyl 1-(1-{2-[acetyl(methyl)amino]propanoyl}-2-pyrrolidinyl)-6-benzyl-3-isobutyl-9-isopropyl-2,5,8,11-tetramethyl-1,4,7,10-tetraoxo-2,5,8,11-tetraazatridecan-13-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H60N6O8
InChI InChI=1S/C38H60N6O8/c1-24(2)21-30(41(9)35(48)29-19-16-20-44(29)34(47)26(5)40(8)27(6)45)36(49)42(10)31(22-28-17-14-13-15-18-28)37(50)43(11)33(25(3)4)38(51)39(7)23-32(46)52-12/h13-15,17-18,24-26,29-31,33H,16,19-23H2,1-12H3
InChIKey WHCWPQBPOIKJSW-UHFFFAOYSA-N
Molecular Weight 728.932 g/mol
SMILES C(N1C(C(N(C(C(N(C(C(N(C(C(N(CC(=O)OC)C)=O)C(C)C)C)=O)Cc2ccccc2)C)=O)CC(C)C)C)=O)CCC1)(C(N(C(=O)C)C)C)=O
SPLASH splash10-0fb9-0988010000-20612979df0e3995f5da
Source of Spectrum BS-1-62-0
Wiley ID 1415863