| SpectraBase Spectrum ID |
9i8CgejEiJm |
| Name |
(2R,3R)-O-Acetyl-3-bromo-N-tert-butyl-N(,alpha.)-phthaloyltyrosinamide |
| Alternate Name(s) |
4-{(R)-bromo[(3R)-2-tert-butyl-1,4,6-trioxo-1,2,3,4,5,6-hexahydro-2,5-benzodiazocin-3-yl]methyl}phenyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H23BrN2O5 |
| InChI |
InChI=1S/C23H23BrN2O5/c1-13(27)31-15-11-9-14(10-12-15)18(24)19-21(29)25-20(28)16-7-5-6-8-17(16)22(30)26(19)23(2,3)4/h5-12,18-19H,1-4H3,(H,25,28,29)/t18-,19+/m1/s1 |
| InChIKey |
MGUIIBJGMRTPNY-MOPGFXCFSA-N |
| Molecular Weight |
487.350 g/mol |
| SMILES |
N1C(c2c(C(N([C@](C1=O)([C@@](c1ccc(OC(=O)C)cc1)(Br)[H])[H])C(C)(C)C)=O)cccc2)=O |
| SPLASH |
splash10-014i-0392100000-1d8e617d42589fedef1a |
| Source of Spectrum |
F-50-7336-13 |
| Wiley ID |
1396401 |
