Stereochemistry | ACHIRAL |
Molecular Formula | C14H19N5O4S.C6H8O7 |
Molecular Weight | 545.52 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.COC1=C(C=C(OC2=C(N)N=C(N)N=C2)C(=C1)C(C)C)S(N)(=O)=O
InChI
InChIKey=AIJVJYUOMCRFOE-UHFFFAOYSA-N
InChI=1S/C14H19N5O4S.C6H8O7/c1-7(2)8-4-10(22-3)12(24(17,20)21)5-9(8)23-11-6-18-14(16)19-13(11)15;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-7H,1-3H3,(H2,17,20,21)(H4,15,16,18,19);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)