SpectraBase Spectrum ID |
AnUTl4l4geb |
Name |
(1R,2S,4S,1'R,2'R,1''R,2"R,4"S)-N-{cis-2'-[2"-Hydroxy-7",7"-dimethylbicyclo[2.2.1]hept-1"-ylmethylsulfonamino]cyclohexyl}-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-ylmethanesulfonamide |
Alternate Name(s) |
[(1R,2R,4S)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl]-N-{(1R,2R)-2-[({[(1R,2S,4S)-2-hydroxy-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methyl}sulfonyl)amino]cyclohexyl}methanesulfonamide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H46N2O6S2 |
InChI |
InChI=1S/C26H46N2O6S2/c1-23(2)17-9-11-25(23,21(29)13-17)15-35(31,32)27-19-7-5-6-8-20(19)28-36(33,34)16-26-12-10-18(14-22(26)30)24(26,3)4/h17-22,27-30H,5-16H2,1-4H3/t17-,18-,19+,20+,21-,22+,25-,26-/m0/s1 |
InChIKey |
KVVHJCZXSZVOLS-ZBPGYVGGSA-N |
Molecular Weight |
546.782 g/mol |
SMILES |
O[C@@]1(C[C@]2(C([C@]1(CS(N[C@]1([C@](NS(C[C@]34[C@](C[C@](C4(C)C)([H])CC3)(O)[H])(=O)=O)(CCCC1)[H])[H])(=O)=O)CC2)(C)C)[H])[H] |
SPLASH |
splash10-01p6-4900000000-2807da5847150ec3259f |
Source of Spectrum |
QE-12-4441-6 |
Wiley ID |
1587042 |