Stereochemistry | MIXED |
Molecular Formula | C23H21N3O8S |
Molecular Weight | 499.493 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 4 |
E/Z Centers | 0 |
Charge | 0 |
Stereo Comments | Assumed mixed |
SHOW SMILES / InChI
SMILES
[O-][S+]1CC(=C)C(N2[C@H]1[C@H](NC(=O)COC3=CC=CC=C3)C2=O)C(=O)OCC4=CC=C(C=C4)[N+]([O-])=O
InChI
InChIKey=HBKWKOGDTHDLLR-KVDBJTRHSA-N
InChI=1S/C23H21N3O8S/c1-14-13-35(32)22-19(24-18(27)12-33-17-5-3-2-4-6-17)21(28)25(22)20(14)23(29)34-11-15-7-9-16(10-8-15)26(30)31/h2-10,19-20,22H,1,11-13H2,(H,24,27)/t19-,20?,22-,35?/m1/s1
Molecular Formula | C23H21N3O8S |
Molecular Weight | 499.493 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | EPIMERIC |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |