SpectraBase Compound ID | GnqLgayn6tv |
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InChI | InChI=1S/C34H39N3O11S/c1-21(2)18-29(34(44)47-20-23-6-4-3-5-7-23)37-32(41)28(36-31(40)27(35)16-17-30(38)39)19-22-8-12-25(13-9-22)48-49(45,46)26-14-10-24(11-15-26)33(42)43/h3-15,21,27-29H,16-20,35H2,1-2H3,(H,36,40)(H,37,41)(H,38,39)(H,42,43)/t27-,28-,29+/m0/s1 |
InChIKey | CIOHEOAFFIITEZ-YTCPBCGMSA-N |
Mol Weight | 697.8 g/mol |
Molecular Formula | C34H39N3O11S |
Exact Mass | 697.23053 g/mol |
SpectraBase Spectrum ID | HeLjcURx1Jn |
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Name | H-GLU-TYR-[SO2C6H4(4-COOH)]-LEU-OBZL |
Compound Number | 16 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H39N3O11S |
InChI | InChI=1S/C34H39N3O11S/c1-21(2)18-29(34(44)47-20-23-6-4-3-5-7-23)37-32(41)28(36-31(40)27(35)16-17-30(38)39)19-22-8-12-25(13-9-22)48-49(45,46)26-14-10-24(11-15-26)33(42)43/h3-15,21,27-29H,16-20,35H2,1-2H3,(H,36,40)(H,37,41)(H,38,39)(H,42,43)/t27-,28-,29+/m0/s1 |
InChIKey | CIOHEOAFFIITEZ-YTCPBCGMSA-N |
Literature Reference Author | G.ROSSE,U.SEQUIN,H.METT,P.FURET,P.TRAXLER,H.FRETZ |
Literature Reference Citation | HELV.CHIM.ACTA,80,653(1997) |
Literature Reference DOI | 10.1002/hlca.19970800304 |
Molecular Weight | 697.757 g/mol |
Solvent | ACETONE-D6 |
Source File Reference | UWCP3883 |