Fucalpha1-3GlcNAcbeta1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM26218 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C85H150N4O40 charge 0 mass 1866.98264 reference lipidmapsM:LMSP0601BT01 InChIKey PLTJAIZEMMSSBW-ILOHFPQGSA-N InChI InChI=1S/C85H150N4O40/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-48(99)47(89-56(102)34-32-30-28-26-24-22-20-18-16-14-12-10-8-2)42-116-80-68(111)66(109)71(54(40-94)121-80)123-83-70(113)77(129-85(84(114)115)35-49(100)57(86-44(4)96)75(128-85)61(104)50(101)36-90)72(55(41-95)122-83)124-78-58(87-45(5)97)74(63(106)51(37-91)118-78)126-82-69(112)76(64(107)53(39-93)120-82)127-79-59(88-46(6)98)73(62(105)52(38-92)119-79)125-81-67(110)65(108)60(103)43(3)117-81/h31,33,43,47-55,57-83,90-95,99-101,103-113H,7-30,32,34-42H2,1-6H3,(H,86,96)(H,87,97)(H,88,98)(H,89,102)(H,114,115)/b33-31+/t43?,47-,48+,49?,50+,51?,52?,53?,54?,55?,57+,58?,59?,60+,61+,62+,63-,64-,65?,66+,67-,68?,69?,70?,71+,72-,73+,74+,75?,76-,77+,78-,79-,80+,81+,82-,83-,85-/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O[C@@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O)[C@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)C5NC(C)=O)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph