NeuAcalpha2-6Galbeta1-4GlcNAcbeta1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM29913 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C85H150N4O41 charge 0 mass 1882.97755 reference lipidmapsM:LMSP0601FE01 InChIKey ZGYGBQQQXBOBNJ-JKZPFMQKSA-N InChI InChI=1S/C85H150N4O41/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-47(98)46(89-56(101)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)40-117-80-71(113)68(110)75(53(39-94)123-80)128-83-72(114)77(63(105)54(124-83)41-118-78-58(87-44(4)96)64(106)73(51(37-92)121-78)126-81-69(111)66(108)61(103)50(36-91)120-81)129-79-59(88-45(5)97)65(107)74(52(38-93)122-79)127-82-70(112)67(109)62(104)55(125-82)42-119-85(84(115)116)34-48(99)57(86-43(3)95)76(130-85)60(102)49(100)35-90/h30,32,46-55,57-83,90-94,98-100,102-114H,6-29,31,33-42H2,1-5H3,(H,86,95)(H,87,96)(H,88,97)(H,89,101)(H,115,116)/b32-30+/t46-,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]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)[C@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph