![(Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL](/api/spectrum/5az7O4l07Rg/structure.png?h=300&w=458 "(Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL")
| SpectraBase Compound ID | Hu2iqC4n0O6 |
|---|---|
| InChI | InChI=1S/C29H41Cl3N4O10S/c1-17(2)22(36-23(38)21(14-47-16-33-18(3)37)35-27(42)46-28(4,5)6)25(40)43-13-20(24(39)45-15-29(30,31)32)34-26(41)44-12-19-10-8-7-9-11-19/h7-11,17,20-22H,12-16H2,1-6H3,(H,33,37)(H,34,41)(H,35,42)(H,36,38)/t20-,21+,22+/m1/s1 |
| InChIKey | HCUPPAXIQHIFPT-FSSWDIPSSA-N |
| Mol Weight | 744.1 g/mol |
| Molecular Formula | C29H41Cl3N4O10S |
| Exact Mass | 742.160898 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5az7O4l07Rg |
|---|---|
| Name | (Z)-D-SERINE-[N-BUTYLOXYCARBONYL-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H41Cl3N4O10S |
| InChI | InChI=1S/C29H41Cl3N4O10S/c1-17(2)22(36-23(38)21(14-47-16-33-18(3)37)35-27(42)46-28(4,5)6)25(40)43-13-20(24(39)45-15-29(30,31)32)34-26(41)44-12-19-10-8-7-9-11-19/h7-11,17,20-22H,12-16H2,1-6H3,(H,33,37)(H,34,41)(H,35,42)(H,36,38)/t20-,21+,22+/m1/s1 |
| InChIKey | HCUPPAXIQHIFPT-FSSWDIPSSA-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 | 744.084 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21412 |