Ganglioside GT3 (d18:1(4E)/iso15:0)

Properties Image Occurences in reactions MNX_ID MNXM525680 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C78H133N4O37 charge -3 mass 1717.86651 reference slm:000487100 InChIKey UIFASPYJUNQKSS-BTIDRCOBSA-K InChI InChI=1S/C78H136N4O37/c1-7-8-9-10-11-12-13-14-15-18-21-24-27-30-46(91)45(82-55(96)31-28-25-22-19-16-17-20-23-26-29-41(2)3)40-110-71-64(102)63(101)66(54(39-87)112-71)113-72-65(103)70(60(98)51(36-84)111-72)119-78(75(108)109)34-49(94)58(81-44(6)90)69(118-78)62(100)53(38-86)115-77(74(106)107)33-48(93)57(80-43(5)89)68(117-77)61(99)52(37-85)114-76(73(104)105)32-47(92)56(79-42(4)88)67(116-76)59(97)50(95)35-83/h27,30,41,45-54,56-72,83-87,91-95,97-103H,7-26,28-29,31-40H2,1-6H3,(H,79,88)(H,80,89)(H,81,90)(H,82,96)(H,104,105)(H,106,107)(H,108,109)/p-3/b30-27+/t45-,46+,47-,48-,49-,50+,51+,52+,53+,54+,56+,57+,58+,59+,60-,61+,62+,63+,64+,65+,66+,67+,68+,69+,70-,71+,72-,76+,77+,78-/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](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](CO)O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCC(C)C

Parent-child relations graph

Deprecated MNXref IDs graph