Stereochemistry | ACHIRAL |
Molecular Formula | C31H28N2O13S.4Na |
Molecular Weight | 760.584 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].CC1=C(O)C(CN(CC([O-])=O)CC([O-])=O)=CC(=C1)C2(OS(=O)(=O)C3=CC=CC=C23)C4=CC(C)=C(O)C(CN(CC([O-])=O)CC([O-])=O)=C4
InChI
InChIKey=YIIQUYHVWRJXEM-UHFFFAOYSA-J
InChI=1S/C31H32N2O13S.4Na/c1-17-7-21(9-19(29(17)42)11-32(13-25(34)35)14-26(36)37)31(23-5-3-4-6-24(23)47(44,45)46-31)22-8-18(2)30(43)20(10-22)12-33(15-27(38)39)16-28(40)41;;;;/h3-10,42-43H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41);;;;/q;4*+1/p-4