C11 TOPFLUOR GALACTOSYL CERAMIDE

1246355-61-2

MFCD22416774

C48 H80 B F2 N3 O8

875.98

InChI=1S/C48H80BF2N3O8/c1-6-7-8-9-10-11-12-13-14-15-19-22-25-28-40(56)39(33-61-48-47(60)46(59)45(58)41(32-55)62-48)52-42(57)29-26-23-20-17-16-18-21-24-27-38-43-34(2)30-36(4)53(43)49(50,51)54-37(5)31-35(3)44(38)54/h25,28,30-31,39-41,45-48,55-56,58-60H,6-24,26-27,29,32-33H2,1-5H3,(H,52,57)/b28-25+/t39-,40+,41+,45-,46-,47+,48+/m0/s1

InChIKey=JFSRTAWSWJIVBO-YHUZCVEMSA-N

[B-]1(n2c(cc(c2C(=C3[N+]1=C(C=C3C)C)CCCCCCCCCCC(=O)N[C@@H](CO[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O)C)C)(F)F

H bond donor:6

H bond acceptor:11

XLogP3:7.0

Bulk/Fine:F