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L-Leucine, N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[(phenylmethoxy)carbonyl]-L-alanyl]-L-valyl]glycyl]-L-leucyl]-L-alanyl]-L-valyl]glycyl]-, methyl ester

View entire compound with spectra: 1 MS (GC)

L-Leucine, N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[(phenylmethoxy)carbonyl]-L-alanyl]-L-valyl]glycyl]-L-leucyl]-L-alanyl]-L-valyl]glycyl]-, methyl ester
SpectraBase Compound ID 14QaUXahUXl
InChI InChI=1S/C49H82N8O11/c1-30(2)25-37(45(62)52(13)34(9)43(60)56(17)41(32(5)6)46(63)51(12)28-40(59)55(16)38(26-31(3)4)48(65)67-19)54(15)39(58)27-50(11)47(64)42(33(7)8)57(18)44(61)35(10)53(14)49(66)68-29-36-23-21-20-22-24-36/h20-24,30-35,37-38,41-42H,25-29H2,1-19H3
InChIKey ZQRNIIHJCVMABQ-UHFFFAOYSA-N
Mol Weight 959.2 g/mol
Molecular Formula C49H82N8O11
Exact Mass 958.610305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65BbipeGxNh
Name L-Leucine, N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[N-methyl-N-[(phenylmethoxy)carbonyl]-L-alanyl]-L-valyl]glycyl]-L-leucyl]-L-alanyl]-L-valyl]glycyl]-, methyl ester
CAS Registry Number 56272-44-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C49H82N8O11
InChI InChI=1S/C49H82N8O11/c1-30(2)25-37(45(62)52(13)34(9)43(60)56(17)41(32(5)6)46(63)51(12)28-40(59)55(16)38(26-31(3)4)48(65)67-19)54(15)39(58)27-50(11)47(64)42(33(7)8)57(18)44(61)35(10)53(14)49(66)68-29-36-23-21-20-22-24-36/h20-24,30-35,37-38,41-42H,25-29H2,1-19H3
InChIKey ZQRNIIHJCVMABQ-UHFFFAOYSA-N
Molecular Weight 959.240 g/mol
SMILES CC(C)CC(C(N(C)C(C)C(N(C)C(C(C)C)C(N(C)CC(N(C)C(CC(C)C)C(=O)OC)=O)=O)=O)=O)N(C)C(CN(C)C(C(C(C)C)N(C)C(C(C)N(C)C(=O)OCc1ccccc1)=O)=O)=O
SPLASH splash10-001i-0149222000-613bcaba68c441deab66
Source of Spectrum W-15-418-6
Synonyms Methyl 14,26-diisobutyl-8,20-diisopropyl-4,5,7,10,13,16,17,19,22,25-decamethyl-3,6,9,12,15,18,21,24-octaoxo-1-phenyl-2-oxa-4,7,10,13,16,19,22,25-octaazaheptacosan-27-oate 2-[[2-[[2-[2-[[2-[[2-[[2-[2-[carbobenzoxy(methyl)amino]propanoyl-methyl-amino]-3-methyl-butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-pentanoyl]-methyl-amino]propanoyl-methyl-amino]-3-methyl-butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-valeric acid methyl ester 4-Methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl-[4-methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl(phenylmethoxycarbonyl)amino]-1-oxopropyl]amino]-1-oxobutyl]amino]-1-oxoethyl]amino]-1-oxopentyl]amino]-1-oxopropyl]amino]-1-oxobutyl]amino]-1-oxoethyl]amino]pentanoic acid methyl ester Methyl 2-[[2-[[2-[2-[[2-[[2-[[2-[2-[benzyloxycarbonyl(methyl)amino]propanoyl-methyl-amino]-3-methyl-butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-pentanoyl]-methyl-amino]propanoyl-methyl-amino]-3-methyl-butanoyl]-methyl-amino]acetyl]-methyl-amino]-4-methyl-pentanoate Methyl 4-methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl-[4-methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl(phenylmethoxycarbonyl)amino]propanoyl]amino]butanoyl]amino]acetyl]amino]pentanoyl]amino]propanoyl]amino]butanoyl]amino]acetyl]amino]pentanoate Methyl 4-methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl-[4-methyl-2-[methyl-[2-[methyl-[3-methyl-2-[methyl-[2-[methyl(phenylmethoxycarbonyl)amino]propanoyl]amino]butanoyl]amino]ethanoyl]amino]pentanoyl]amino]propanoyl]amino]butanoyl]amino]ethanoyl]amino]pentanoate
Wiley ID 1418266