| SpectraBase Spectrum ID |
JpfPjKFqTLg |
| Name |
(2S,5R,8S,11R,Z)-methyl 2,5,8,11-tetraisobutyl-14-((S)-3-isopropyl-1-oxo-2,3-dihydroisoquinolin-4(1H)-ylidene)-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecan-1-oate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C39H61N5O7 |
| InChI |
InChI=1S/C39H61N5O7/c1-21(2)16-29(40-33(45)20-28-26-14-12-13-15-27(26)35(46)44-34(28)25(9)10)36(47)41-30(17-22(3)4)37(48)42-31(18-23(5)6)38(49)43-32(19-24(7)8)39(50)51-11/h12-15,20-25,29-32,34H,16-19H2,1-11H3,(H,40,45)(H,41,47)(H,42,48)(H,43,49)(H,44,46)/b28-20-/t29-,30+,31-,32+,34+/m1/s1 |
| InChIKey |
RBSYDRPHNBQISM-NMFGRZDVSA-N |
| Literature Reference DOI |
10.1002_1615-4169(200209)344_8_855 |
| Molecular Weight |
711.945 g/mol |
| SMILES |
N1[C@](\C(=C/C(N[C@@](C(N[C@](C(=O)N[C@@](C(=O)N[C@@](CC(C)C)(C(=O)OC)[H])(CC(C)C)[H])(CC(C)C)[H])=O)(CC(C)C)[H])=O)c2ccccc2C1=O)(C(C)C)[H] |
| SPLASH |
splash10-0f9i-3293400100-9a685df80852fa9cab8d |
| Source of Spectrum |
ASC-344-862-12 |
| Wiley ID |
1767319 |
