![#12B;(Z)-D-SERINE-[9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-L-ALANINE-L-CYSTEINE-(ACETAMIDOMET](/api/spectrum/89INAuvYYl/structure.png?h=300&w=458 "#12B;(Z)-D-SERINE-[9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-L-ALANINE-L-CYSTEINE-(ACETAMIDOMET")
| SpectraBase Compound ID | GiaDWmSbzIs |
|---|---|
| InChI | InChI=1S/C62H84N10O19S2/c1-33(2)49(71-55(79)48(30-93-32-64-38(8)74)68-52(76)36(6)66-61(86)91-62(9,10)11)57(82)87-27-45(69-59(84)90-26-44-42-23-17-15-21-40(42)41-22-16-18-24-43(41)44)53(77)65-35(5)51(75)67-47(29-92-31-63-37(7)73)54(78)72-50(34(3)4)58(83)88-28-46(56(80)81)70-60(85)89-25-39-19-13-12-14-20-39/h12-24,33-36,44-50H,25-32H2,1-11H3,(H,63,73)(H,64,74)(H,65,77)(H,66,86)(H,67,75)(H,68,76)(H,69,84)(H,70,85)(H,71,79)(H,72,78)(H,80,81)/t35-,36+,45+,46-,47-,48+,49+,50-/m1/s1 |
| InChIKey | QLOSCPXZTLCYTB-NCSGKPARSA-N |
| Mol Weight | 1337.5 g/mol |
| Molecular Formula | C62H84N10O19S2 |
| Exact Mass | 1336.535563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 89INAuvYYl |
|---|---|
| Name | #12B;(Z)-D-SERINE-[9-FLUORENYL-METHYLOXYCARBONYL-D-SERINE-[BUTYLOXYCARBONYL-L-ALANINE-L-CYSTEINE-(ACETAMIDOMETHYL)-L-VALINE]-L-ALANINE-L-CYSTEINE-(ACETAMIDOMET |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H84N10O19S2 |
| InChI | InChI=1S/C62H84N10O19S2/c1-33(2)49(71-55(79)48(30-93-32-64-38(8)74)68-52(76)36(6)66-61(86)91-62(9,10)11)57(82)87-27-45(69-59(84)90-26-44-42-23-17-15-21-40(42)41-22-16-18-24-43(41)44)53(77)65-35(5)51(75)67-47(29-92-31-63-37(7)73)54(78)72-50(34(3)4)58(83)88-28-46(56(80)81)70-60(85)89-25-39-19-13-12-14-20-39/h12-24,33-36,44-50H,25-32H2,1-11H3,(H,63,73)(H,64,74)(H,65,77)(H,66,86)(H,67,75)(H,68,76)(H,69,84)(H,70,85)(H,71,79)(H,72,78)(H,80,81)/t35-,36+,45+,46-,47-,48+,49+,50-/m1/s1 |
| InChIKey | QLOSCPXZTLCYTB-NCSGKPARSA-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 | 1337.525 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN21427 |