![(Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL](/api/spectrum/61emkNnwbXC/structure.png?h=300&w=458 "(Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL")
| SpectraBase Compound ID | FFHFitq1fOQ |
|---|---|
| InChI | InChI=1S/C32H46Cl3N5O11S/c1-18(2)24(40-26(43)23(15-52-17-36-20(4)41)38-25(42)19(3)37-30(47)51-31(5,6)7)28(45)48-14-22(27(44)50-16-32(33,34)35)39-29(46)49-13-21-11-9-8-10-12-21/h8-12,18-19,22-24H,13-17H2,1-7H3,(H,36,41)(H,37,47)(H,38,42)(H,39,46)(H,40,43)/t19-,22+,23-,24-/m0/s1 |
| InChIKey | XCCZUUKVTPMSJY-UQAQOTMJSA-N |
| Mol Weight | 815.2 g/mol |
| Molecular Formula | C32H46Cl3N5O11S |
| Exact Mass | 813.198012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 61emkNnwbXC |
|---|---|
| Name | (Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H46Cl3N5O11S |
| InChI | InChI=1S/C32H46Cl3N5O11S/c1-18(2)24(40-26(43)23(15-52-17-36-20(4)41)38-25(42)19(3)37-30(47)51-31(5,6)7)28(45)48-14-22(27(44)50-16-32(33,34)35)39-29(46)49-13-21-11-9-8-10-12-21/h8-12,18-19,22-24H,13-17H2,1-7H3,(H,36,41)(H,37,47)(H,38,42)(H,39,46)(H,40,43)/t19-,22+,23-,24-/m0/s1 |
| InChIKey | XCCZUUKVTPMSJY-UQAQOTMJSA-N |
| Literature Reference Author | K.B.LORENZ,U.DIEDERICHSEN |
| Literature Reference Citation | J.ORG.CHEM.,69,3917(2004) |
| Literature Reference DOI | 10.1021/jo0496805 |
| Molecular Weight | 815.163 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21413 |