Ganglioside GD1b (d18:1(4E)/2:0)

Properties Image Occurences in reactions MNX_ID MNXM522800 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C68H114N4O39 charge -2 mass 1610.70712 reference slm:000487319 InChIKey PFLWPNBAZRTSKD-WAMSSFRQSA-L InChI InChI=1S/C68H116N4O39/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-34(83)33(69-29(2)79)28-100-62-53(94)51(92)55(41(26-77)103-62)105-64-54(95)60(56(42(27-78)104-64)106-61-45(72-32(5)82)57(48(89)39(24-75)101-61)107-63-52(93)50(91)47(88)38(23-74)102-63)111-68(66(98)99)21-36(85)44(71-31(4)81)59(110-68)49(90)40(25-76)108-67(65(96)97)20-35(84)43(70-30(3)80)58(109-67)46(87)37(86)22-73/h18-19,33-64,73-78,83-95H,6-17,20-28H2,1-5H3,(H,69,79)(H,70,80)(H,71,81)(H,72,82)(H,96,97)(H,98,99)/p-2/b19-18+/t33-,34+,35-,36-,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47-,48-,49+,50-,51+,52+,53+,54+,55+,56-,57+,58+,59+,60+,61-,62+,63-,64-,67+,68-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph