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Leucine, N-[N-[N-(N-stearoyl-L-alanyl)-L-valyl]glycyl]-, methyl ester, L-
SpectraBase Compound ID 6hbYrGl7c9F
InChI InChI=1S/C35H66N4O6/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-30(40)37-28(6)33(42)39-32(27(4)5)34(43)36-25-31(41)38-29(24-26(2)3)35(44)45-7/h26-29,32H,8-25H2,1-7H3,(H,36,43)(H,37,40)(H,38,41)(H,39,42)
InChIKey UAYRREJCRHJQOL-UHFFFAOYSA-N
Mol Weight 638.9 g/mol
Molecular Formula C35H66N4O6
Exact Mass 638.498236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2J8Ifj45Fw
Name Leucine, N-[N-[N-(N-stearoyl-L-alanyl)-L-valyl]glycyl]-, methyl ester, L-
CAS Registry Number 4560-73-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H66N4O6
InChI InChI=1S/C35H66N4O6/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-30(40)37-28(6)33(42)39-32(27(4)5)34(43)36-25-31(41)38-29(24-26(2)3)35(44)45-7/h26-29,32H,8-25H2,1-7H3,(H,36,43)(H,37,40)(H,38,41)(H,39,42)
InChIKey UAYRREJCRHJQOL-UHFFFAOYSA-N
Molecular Weight 638.935 g/mol
SMILES N(C(C(OC)=O)CC(C)C)C(CNC(C(NC(C(NC(CCCCCCCCCCCCCCCCC)=O)C)=O)C(C)C)=O)=O
SPLASH splash10-006x-9111000000-9dc050469d22b08b00cf
Source of Spectrum D-4-2256-3
Synonyms Methyl 2-isobutyl-8-isopropyl-11-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazatriacontan-1-oate 4-Methyl-2-[[2-[[3-methyl-1-oxo-2-[[1-oxo-2-(1-oxooctadecylamino)propyl]amino]butyl]amino]-1-oxoethyl]amino]pentanoic acid methyl ester 4-Methyl-2-[[2-[[3-methyl-2-(2-stearamidopropanoylamino)butanoyl]amino]acetyl]amino]valeric acid methyl ester Methyl 4-methyl-2-[2-[[3-methyl-2-[2-(octadecanoylamino)propanoylamino]butanoyl]amino]ethanoylamino]pentanoate Methyl 4-methyl-2-[[2-[[3-methyl-2-[2-(octadecanoylamino)propanoylamino]butanoyl]amino]acetyl]amino]pentanoate
Wiley ID 1412513