B-D-GLUCOPYRANOSIDE, PHENYL 1-THIO-, 2,3,4-TRIS(4-METHYLBENZOATE)

591766-60-8

MFCD13182773

C36H34O8S

626.723

InChI=1S/C36H34O8S/c1-22-9-15-25(16-10-22)33(38)42-30-29(21-37)41-36(45-28-7-5-4-6-8-28)32(44-35(40)27-19-13-24(3)14-20-27)31(30)43-34(39)26-17-11-23(2)12-18-26/h4-20,29-32,36-37H,21H2,1-3H3/t29-,30-,31+,32-,36+/m1/s1

InChIKey=PFZUKLPCOGLAHJ-RWRPUETGSA-N

CC1=CC=C(C=C1)C(=O)O[C@@H]1[C@@H](CO)O[C@@H](SC2=CC=CC=C2)[C@H](OC(=O)C2=CC=C(C)C=C2)[C@H]1OC(=O)C1=CC=C(C)C=C1

H bond donor:1

H bond acceptor:8

XLogP3:7.327

Bulk/Fine:F