| SpectraBase Spectrum ID |
B1jhnAuwQ8T |
| Name |
(1S,2R,4S,1'S,2'R,4'S)-N-{4-(2'-Hydroxy-7',7'-dimethylbicyclo[2.2.1]hept-1'-ylmethylsulfonamidomethyl)benzyl}-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-ylmethanesulfonamide |
| Alternate Name(s) |
[(1S,2R,4S)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl]-N-(4-{[({[(1S,2R,4S)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methyl}amino)sulfonyl]methyl}benzyl)methanesulfonamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H44N2O6S2 |
| InChI |
InChI=1S/C28H44N2O6S2/c1-25(2)21-9-11-27(25,23(31)13-21)17-30-37(33,34)16-20-7-5-19(6-8-20)15-29-38(35,36)18-28-12-10-22(14-24(28)32)26(28,3)4/h5-8,21-24,29-32H,9-18H2,1-4H3/t21-,22+,23-,24-,27-,28-/m1/s1 |
| InChIKey |
YPBGXRLMHBZMSW-KRXZIQNWSA-N |
| Molecular Weight |
568.788 g/mol |
| SMILES |
O[C@@]1(C[C@]2(C([C@@]1(CS(NCc1ccc(CS(NC[C@@]34[C@@](C[C@@](C4(C)C)([H])CC3)(O)[H])(=O)=O)cc1)(=O)=O)CC2)(C)C)[H])[H] |
| SPLASH |
splash10-0540-3902000000-04a444d3416a869c9517 |
| Source of Spectrum |
KD-14-1111-9 |
| Wiley ID |
1636012 |
![(1S,2R,4S,1'S,2'R,4'S)-N-{4-(2'-Hydroxy-7',7'-dimethylbicyclo[2.2.1]hept-1'-ylmethylsulfonamidomethyl)benzyl}-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-ylmethanesulfonamide](/api/spectrum/B1jhnAuwQ8T/structure.png?h=300&w=458 "(1S,2R,4S,1'S,2'R,4'S)-N-{4-(2'-Hydroxy-7',7'-dimethylbicyclo[2.2.1]hept-1'-ylmethylsulfonamidomethyl)benzyl}-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-ylmethanesulfonamide")
