| SpectraBase Spectrum ID |
A5PAnnO6rVr |
| Name |
(9S,19S)-9,19-Diacetamido-4,14-dimethyl-10,20-dioxo-1,11-dioxa-4,14(5,3)bis*thiazole)icosaphane-4,14-diium di-perchlorate salt |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42Cl2N4O14S2 |
| InChI |
InChI=1S/C28H40N4O6S2.2ClHO4/c1-19-25-11-15-37-27(35)24(30-22(4)34)10-6-8-14-32-18-40-26(20(32)2)12-16-38-28(36)23(29-21(3)33)9-5-7-13-31(19)17-39-25;2*2-1(3,4)5/h17-18,23-24H,5-16H2,1-4H3;2*(H,2,3,4,5)/t23-,24-;;/m0../s1 |
| InChIKey |
PJMKZXFUSSKWKC-WLKYSPGFSA-N |
| Molecular Weight |
793.684 g/mol |
| SMILES |
[Cl]([O-])(=O)(=O)=O.N([C@]1(CCCC[n+]2c(c(CCOC([C@](CCCC[n+]3c(c(CCOC1=O)sc3)C)(NC(=O)C)[H])=O)sc2)C)[H])C(=O)C.[Cl]([O-])(=O)(=O)=O |
| SPLASH |
splash10-03di-0900000000-742d20466067f3c80d51 |
| Source of Spectrum |
KC-0-871-38b |
| Wiley ID |
783347 |
