(2S)-N2-[(2S)-N-[(1S,3R,9S,12R,15S)-3,12-DIMETHYL-4,10,13-TRIOXO-2-THIA-5,11,14-TRIAZATRICYCLO-[12.2.1.0(5,9)]-HEPTADECAN-15-YLCARBONYL]-ALANYL]-P
Compound with spectra: 1 NMR
![(2S)-N2-[(2S)-N-[(1S,3R,9S,12R,15S)-3,12-DIMETHYL-4,10,13-TRIOXO-2-THIA-5,11,14-TRIAZATRICYCLO-[12.2.1.0(5,9)]-HEPTADECAN-15-YLCARBONYL]-ALANYL]-P](/api/compound/DCVlZzHOrgH.png?ph=true&h=300&w=458 "(2S)-N2-[(2S)-N-[(1S,3R,9S,12R,15S)-3,12-DIMETHYL-4,10,13-TRIOXO-2-THIA-5,11,14-TRIAZATRICYCLO-[12.2.1.0(5,9)]-HEPTADECAN-15-YLCARBONYL]-ALANYL]-P")
| SpectraBase Compound ID | DCVlZzHOrgH |
|---|---|
| InChI | InChI=1S/C29H40N6O6S/c1-16(24(36)33-21(25(37)30-4)13-19-9-6-5-7-10-19)31-27(39)23-14-20-15-35(23)28(40)17(2)32-26(38)22-11-8-12-34(22)29(41)18(3)42-20/h5-7,9-10,16-18,20-23H,8,11-15H2,1-4H3,(H,30,37)(H,31,39)(H,32,38)(H,33,36)/t16-,17-,18+,20?,21+,22-,23?/m0/s1 |
| InChIKey | GKBMMVDBOPQWCU-ILHQKEFLSA-N |
| Mol Weight | 600.7 g/mol |
| Molecular Formula | C29H40N6O6S |
| Exact Mass | 600.273004 g/mol |
| Enantiomer InChIKey | GKBMMVDBOPQWCU-MJCBIYSQSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
(2S)-N2-(1S,3R,9S,12R,15S)-3,12-DIMETHYL-4,10,13-TRIOXO-2-THIA-5,11,14-TRIAZATRICYCLO-[12.2.1.0(5,9)]-HEPTADECAN-15-YLCARBONYL)-PHENYLALANINE-METH
(3S,9S,15R,17S,19S,22S,28S,34R,36S,38S)-15,34-DIMETHYL-2,8,14,21,27,33-HEXAOXO-16,35-DITHIA-1,7,13,20,26,32-HEXAAZAHEPTACYCLO-[34.2.1.1^17,20.0^3,
CYCLOLEONURIPEPTIDE_E;CYCLO-(-ALA-PRO-ILE-VAL-ALA-ALA-PHE-THR-PRO-)
GYPSIN_C;CYCLO-(-ALA(1)-PRO-(2)-TYR-(3)-LEU-(4)-LEU-(5)-PRO-(6)-PRO-(7)-ALA-(8))
STYLOPEPTIDE_1
XENTRIVALPEPTIDE_D
STYLOPEPTIDE_2
DIANTHIN-D;CYCLO-(GLY-(1)-SER-(2)-LEU-(3)-PRO-(4)-PRO-(59-ILE-(6)-PHE-(7))
(2-Phenylalanine-4-leucine)-ocytocin
CHERIMOLACYCLOPEPTIDE_F;CYCLO-(PRO-(1)-GLY-(2)-MET-(3)-GLY-(4)-ILE-(5)-TYR-(6)-LEU-(7)-PRO-(8)-MET-(9))
| Title | Journal or Book | Year |
|---|---|---|
| Design, construction and properties of peptide N-terminal cap templates devised to initiate α-helices. Part 3.† Caps derived from N-[(2S )-2-chloropropionyl]-(2S )-Pro-(2R)-Ala-(2S,4S )-4-thioPro-OMe | Journal of the Chemical Society, Perkin Transactions 1 | 1998 |