| SpectraBase Spectrum ID |
7VIbDwqjNUr |
| Name |
2-(((1S,2S)-2-benzoyl-2-phenylcycloheptyl)amino)isoindoline-1,3-dione |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H26N2O3 |
| InChI |
InChI=1S/C28H26N2O3/c31-25(20-12-4-1-5-13-20)28(21-14-6-2-7-15-21)19-11-3-8-18-24(28)29-30-26(32)22-16-9-10-17-23(22)27(30)33/h1-2,4-7,9-10,12-17,24,29H,3,8,11,18-19H2/t24-,28-/m0/s1 |
| InChIKey |
NQEKWKULZYCQBA-CUBQBAPOSA-N |
| Literature Reference DOI |
10.1021/ol802005n |
| Molecular Weight |
438.527 g/mol |
| SMILES |
N([C@@]1([C@](C(c2ccccc2)=O)(CCCCC1)c1ccccc1)[H])N1C(c2c(C1=O)cccc2)=O |
| SPLASH |
splash10-0fba-4900000000-3c59160f1f559d1d6c33 |
| Source of Spectrum |
A1-10-4943/SMS7-3j |
| Wiley ID |
1760008 |
