WOODFORDIN C

126347-63-5

MFCD03700781

C75 H52 O48

1721.19

InChI=1S/C75H52O48/c76-24-1-15(2-25(77)42(24)86)65(101)119-61-59-36-13-111-68(104)18-7-30(82)45(89)51(95)38(18)41-21(71(107)117-59)12-35(50(94)54(41)98)114-58-23(10-33(85)48(92)56(58)100)73(109)122-64-62(120-66(102)16-3-26(78)43(87)27(79)4-16)60-37(116-75(64)123-67(103)17-5-28(80)44(88)29(81)6-17)14-112-69(105)20-11-34(49(93)53(97)40(20)39-19(70(106)118-60)8-31(83)46(90)52(39)96)113-57-22(9-32(84)47(91)55(57)99)72(108)121-63(61)74(110)115-36/h1-12,36-37,59-64,74-100,110H,13-14H2/t36-,37-,59-,60-,61+,62+,63-,64-,74-,75+/m1/s1

InChIKey=IVHVAYKUGPKWCF-YHDRLSMHSA-N

c1c(cc(c(c1O)O)O)C(=O)O[C@H]2[C@H]3[C@H]4COC(=O)c5cc(c(c(c5-c6c(cc(c(c6O)O)Oc7c(cc(c(c7O)O)O)C(=O)O[C@@H]8[C@H]([C@H]9[C@@H](COC(=O)c1cc(c(c(c1-c1c(cc(c(c1O)O)O)C(=O)O9)O)O)Oc1c(cc(c(c1O)O)O)C(=O)O[C@H]2[C@@H](O4)O)O[C@H]8OC(=O)c1cc(c(c(c1)O)O)O)OC(=O)c1cc(c(c(c1)O)O)O)C(=O)O3)O)O)O

pro_donors:26

pro_acceptors:48

XLogP3:1.0

Bulk/Fine:F