| SpectraBase Spectrum ID |
KbxT6gRCZsy |
| Name |
L-Tryptophan, 2-[3-methyl-1-oxo-3-(phenylthio)butyl]-N-[1-[(2,2,2-trichloroethoxy)carbonyl]-L-prolyl]-, methyl ester |
| CAS Registry Number |
116612-00-1 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H34Cl3N3O6S |
| InChI |
InChI=1S/C31H34Cl3N3O6S/c1-30(2,44-19-10-5-4-6-11-19)17-25(38)26-21(20-12-7-8-13-22(20)35-26)16-23(28(40)42-3)36-27(39)24-14-9-15-37(24)29(41)43-18-31(32,33)34/h4-8,10-13,23-24,35H,9,14-18H2,1-3H3,(H,36,39)/t23-,24-/m0/s1 |
| InChIKey |
TVEVWAOYDGUHLJ-ZEQRLZLVSA-N |
| Molecular Weight |
683.047 g/mol |
| SMILES |
[nH]1c2c(c(C[C@](NC([C@]3(N(C(OCC(Cl)(Cl)Cl)=O)CCC3)[H])=O)(C(=O)OC)[H])c1C(CC(Sc1ccccc1)(C)C)=O)cccc2 |
| SPLASH |
splash10-03l0-4390000000-7997e709ea57496e95d3 |
| Source of Spectrum |
F-44-370-31 |
| Synonyms |
(N-2,2,2-tricloroethylcarboxyprolyl)-.delta.-(3-methyl-3-phenylthiobutanonyl)tryptophane methyl ester
2,2,2-trichloroethyl (2S)-2-({[(1S)-2-methoxy-1-({2-[3-methyl-3-(phenylsulfanyl)butanoyl]-1H-indol-3-yl}methyl)-2-oxoethyl]amino}carbonyl)-1-pyrrolidinecarboxylate
2-(3-Methyl-3-phenylthiobutanonyl)-3-(2-methylcarboxy-2-((n-2,2,2-trichloroethylcarboxyprolyl)amino)ethyl)indole |
| Wiley ID |
1414367 |
![L-Tryptophan, 2-[3-methyl-1-oxo-3-(phenylthio)butyl]-N-[1-[(2,2,2-trichloroethoxy)carbonyl]-L-prolyl]-, methyl ester](/api/spectrum/KbxT6gRCZsy/structure.png?h=300&w=458 "L-Tryptophan, 2-[3-methyl-1-oxo-3-(phenylthio)butyl]-N-[1-[(2,2,2-trichloroethoxy)carbonyl]-L-prolyl]-, methyl ester")
