SpectraBase Spectrum ID |
AOdt2eM5WIS |
Name |
(2S)-3-(1H-indol-3-yl)-2-[[(2S)-1-oxo-2-(1-pyrenylsulfonylamino)propyl]amino]propanoic acid ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C32H29N3O5S |
InChI |
InChI=1S/C32H29N3O5S/c1-3-40-32(37)27(17-23-18-33-26-10-5-4-9-24(23)26)34-31(36)19(2)35-41(38,39)28-16-14-22-12-11-20-7-6-8-21-13-15-25(28)30(22)29(20)21/h4-16,18-19,27,33,35H,3,17H2,1-2H3,(H,34,36)/t19-,27-/m0/s1 |
InChIKey |
NQWVCDLKJAAUIG-PPHZAIPVSA-N |
Molecular Weight |
567.660 g/mol |
SMILES |
N(S(c1c2c3c4c(cccc4cc2)ccc3cc1)(=O)=O)[C@](C(N[C@@](Cc1c[nH]c2c1cccc2)(C(=O)OCC)[H])=O)(C)[H] |
SPLASH |
splash10-0uyi-0490000000-641cb5b2ead2b092839a |
Source of Spectrum |
J-63-8944-0 |
Synonyms |
(2S)-3-(1H-indol-3-yl)-2-[[(2S)-2-(pyren-1-ylsulfonylamino)propanoyl]amino]propionic acid ethyl ester
Ethyl (2S)-3-(1H-indol-3-yl)-2-[[(2S)-2-(pyren-1-ylsulfonylamino)propanoyl]amino]propanoate |
Wiley ID |
1407434 |