![9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL](/api/spectrum/HEppzUtte2J/structure.png?h=300&w=458 "9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL")
| SpectraBase Compound ID | HSEsp7ce2NU |
|---|---|
| InChI | InChI=1S/C39H50Cl3N5O11S/c1-21(2)31(47-33(50)30(18-59-20-43-23(4)48)45-32(49)22(3)44-37(54)58-38(5,6)7)35(52)55-17-29(34(51)57-19-39(40,41)42)46-36(53)56-16-28-26-14-10-8-12-24(26)25-13-9-11-15-27(25)28/h8-15,21-22,28-31H,16-20H2,1-7H3,(H,43,48)(H,44,54)(H,45,49)(H,46,53)(H,47,50)/t22-,29+,30-,31-/m0/s1 |
| InChIKey | QOXMCKWGIMIMKC-ZFXZTJKDSA-N |
| Mol Weight | 903.3 g/mol |
| Molecular Formula | C39H50Cl3N5O11S |
| Exact Mass | 901.229312 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HEppzUtte2J |
|---|---|
| Name | 9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[N-BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-O-TRICHLOROETHYL |
| Compound Number | 8B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50Cl3N5O11S |
| InChI | InChI=1S/C39H50Cl3N5O11S/c1-21(2)31(47-33(50)30(18-59-20-43-23(4)48)45-32(49)22(3)44-37(54)58-38(5,6)7)35(52)55-17-29(34(51)57-19-39(40,41)42)46-36(53)56-16-28-26-14-10-8-12-24(26)25-13-9-11-15-27(25)28/h8-15,21-22,28-31H,16-20H2,1-7H3,(H,43,48)(H,44,54)(H,45,49)(H,46,53)(H,47,50)/t22-,29+,30-,31-/m0/s1 |
| InChIKey | QOXMCKWGIMIMKC-ZFXZTJKDSA-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 | 903.272 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN21424 |