Stereochemistry | MIXED |
Molecular Formula | C21H31N3O8S |
Molecular Weight | 485.551 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@H](NC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CC2CCNC2=O)C(O)S(O)(=O)=O
InChI
InChIKey=BSPZFJDYQHDZNR-ASPXRTSYSA-N
InChI=1S/C21H31N3O8S/c1-13(2)10-16(24-21(28)32-12-14-6-4-3-5-7-14)19(26)23-17(20(27)33(29,30)31)11-15-8-9-22-18(15)25/h3-7,13,15-17,20,27H,8-12H2,1-2H3,(H,22,25)(H,23,26)(H,24,28)(H,29,30,31)/t15?,16-,17-,20?/m0/s1
Molecular Formula | C21H30N3O8S |
Molecular Weight | 484.543 |
Charge | -1 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | MIXED |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |