| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H24N2O2.C16H18N2O4S |
| Molecular Weight | 658.807 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)CC3=CC=CC=C3)C(O)=O.[H][C@]4(C[C@@H]5CC[N@]4C[C@@H]5C=C)[C@H](O)C6=CC=NC7=C6C=C(OC)C=C7
InChI
InChIKey=XZOMVPUQYPKUQN-UZFPGZSESA-N
InChI=1S/C20H24N2O2.C16H18N2O4S/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t13-,14-,19-,20+;11-,12+,14-/m01/s1
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.4168 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C16H18N2O4S |
| Molecular Weight | 334.39 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
