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L-Leucine, N-[N-[N-[(phenylmethoxy)carbonyl]-L-leucyl]-L-isoleucyl]-, methyl ester
SpectraBase Compound ID DM1roEcGq5c
InChI InChI=1S/C27H43N3O6/c1-8-19(6)23(25(32)28-22(15-18(4)5)26(33)35-7)30-24(31)21(14-17(2)3)29-27(34)36-16-20-12-10-9-11-13-20/h9-13,17-19,21-23H,8,14-16H2,1-7H3,(H,28,32)(H,29,34)(H,30,31)/t19-,21-,22-,23-/m0/s1
InChIKey WQLKJYINNWTUKS-UDIDDNNKSA-N
Mol Weight 505.7 g/mol
Molecular Formula C27H43N3O6
Exact Mass 505.315186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8pNzF3RlH8
Name L-Leucine, N-[N-[N-[(phenylmethoxy)carbonyl]-L-leucyl]-L-isoleucyl]-, methyl ester
Alternate Name(s) Methyl (5S,8S,11S)-5,11-diisobutyl-8-[(1S)-1-methylpropyl]-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate N-Carbobenzoxyleucyl-isoleucyl-leucine methyl ester
CAS Registry Number 76715-78-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H43N3O6
InChI InChI=1S/C27H43N3O6/c1-8-19(6)23(25(32)28-22(15-18(4)5)26(33)35-7)30-24(31)21(14-17(2)3)29-27(34)36-16-20-12-10-9-11-13-20/h9-13,17-19,21-23H,8,14-16H2,1-7H3,(H,28,32)(H,29,34)(H,30,31)/t19-,21-,22-,23-/m0/s1
InChIKey WQLKJYINNWTUKS-UDIDDNNKSA-N
Molecular Weight 505.656 g/mol
SMILES N(C([C@@](NC([C@@](NC(=O)OCc1ccccc1)(CC(C)C)[H])=O)([C@](CC)(C)[H])[H])=O)[C@](C(=O)OC)(CC(C)C)[H]
SPLASH splash10-004r-7692000000-7f0528334b2fcce65d17
Source of Spectrum KO-7-155-3
Wiley ID 1399704