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N-Hydroxysuccinimide ester of N-Carbobenzoxyleucyl-leucyl-leucyl-leucyl-leucine
SpectraBase Compound ID DvkJVPv1tfe
InChI InChI=1S/C42H66N6O10/c1-24(2)18-30(37(51)44-32(20-26(5)6)39(53)46-34(22-28(9)10)41(55)58-48-35(49)16-17-36(48)50)43-38(52)31(19-25(3)4)45-40(54)33(21-27(7)8)47-42(56)57-23-29-14-12-11-13-15-29/h11-15,24-28,30-34H,16-23H2,1-10H3,(H,43,52)(H,44,51)(H,45,54)(H,46,53)(H,47,56)
InChIKey SLENUOTXDQVRFU-UHFFFAOYSA-N
Mol Weight 815.0 g/mol
Molecular Formula C42H66N6O10
Exact Mass 814.484042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fectILomDJ
Name N-Hydroxysuccinimide ester of N-Carbobenzoxyleucyl-leucyl-leucyl-leucyl-leucine
Alternate Name(s) 2,5-Dioxopyrrolidin-1-yl 2-(2-{2-[2-(2-{[(benzyloxy)carbonyl]amino}-4-methylpentanamido)-4-methylpentanamido]-4-methylpentanamido}-4-methylpentanamido)-4-methylpentanoate
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Formula C42H66N6O10
InChI InChI=1S/C42H66N6O10/c1-24(2)18-30(37(51)44-32(20-26(5)6)39(53)46-34(22-28(9)10)41(55)58-48-35(49)16-17-36(48)50)43-38(52)31(19-25(3)4)45-40(54)33(21-27(7)8)47-42(56)57-23-29-14-12-11-13-15-29/h11-15,24-28,30-34H,16-23H2,1-10H3,(H,43,52)(H,44,51)(H,45,54)(H,46,53)(H,47,56)
InChIKey SLENUOTXDQVRFU-UHFFFAOYSA-N
Molecular Weight 815.022 g/mol
SMILES N(C(C(NC(C(NC(C(NC(C(NC(=O)OCc1ccccc1)CC(C)C)=O)CC(C)C)=O)CC(C)C)=O)CC(C)C)=O)C(C(ON1C(CCC1=O)=O)=O)CC(C)C
SPLASH splash10-03dr-5129300400-e53ba5f3bf666cdaf7dd
Source of Spectrum BS-7-153-18
Wiley ID 1417366