| SpectraBase Spectrum ID |
9DibydTe6nk |
| Name |
N-Methyl-N-[(3.alpha.)-23-(3-methylpyridin-4-yl)-24-nor-5.alpha.,22E-chola-7,22-dien-3-yl]-2-nitrobenzenesulfonamide |
| Alternate Name(s) |
N-((3R,5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-((R,E)-4-(3-methylpyridin-4-yl)but-3-en-2-yl)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl)-N-methyl-2-nitrobenze |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H47N3O4S |
| InChI |
InChI=1S/C36H47N3O4S/c1-24(10-11-26-18-21-37-23-25(26)2)30-14-15-31-29-13-12-27-22-28(16-19-35(27,3)32(29)17-20-36(30,31)4)38(5)44(42,43)34-9-7-6-8-33(34)39(40)41/h6-11,13,18,21,23-24,27-28,30-32H,12,14-17,19-20,22H2,1-5H3/b11-10+/t24-,27+,28-,30-,31+,32+,35+,36-/m1/s1 |
| InChIKey |
CUOUKZRETBIHOX-MNNPYMKFSA-N |
| Molecular Weight |
617.849 g/mol |
| SMILES |
c1(S(N([C@]2(C[C@@]3(CC=C4[C@@]([C@]3(CC2)C)(CC[C@@]2([C@@]([C@@](\C=C\c3c(cncc3)C)(C)[H])(CC[C@@]42[H])[H])C)[H])[H])[H])C)(=O)=O)c(N(=O)=O)cccc1 |
| SPLASH |
splash10-05i1-0900120000-cef5d65b8bcaf2974c79 |
| Source of Spectrum |
F-70-1088-14 |
| Wiley ID |
1742428 |
![N-Methyl-N-[(3.alpha.)-23-(3-methylpyridin-4-yl)-24-nor-5.alpha.,22E-chola-7,22-dien-3-yl]-2-nitrobenzenesulfonamide](/api/spectrum/9DibydTe6nk/structure.png?h=300&w=458 "N-Methyl-N-[(3.alpha.)-23-(3-methylpyridin-4-yl)-24-nor-5.alpha.,22E-chola-7,22-dien-3-yl]-2-nitrobenzenesulfonamide")
