Fucalpha1-2(GalNAcalpha1-3)Galbeta1-4GlcNAcbeta1-3(GalNAcalpha1-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM22949 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C114H200N6O57 charge 0 mass 2565.29358 reference lipidmapsM:LMSP0505DY03 InChIKey HVFXNECTHDVQNH-JLCQIYBXSA-N InChI InChI=1S/C114H200N6O57/c1-9-11-13-15-17-19-21-23-24-25-26-28-30-32-34-36-38-40-70(136)120-58(59(135)39-37-35-33-31-29-27-22-20-18-16-14-12-10-2)50-156-109-91(152)89(150)98(68(49-129)167-109)171-112-93(154)100(80(141)63(44-124)162-112)174-107-74(118-56(7)133)86(147)96(66(47-127)165-107)170-113-94(155)101(82(143)69(168-113)51-157-104-73(117-55(6)132)85(146)95(65(46-126)164-104)169-111-92(153)99(79(140)62(43-123)161-111)173-105-71(115-53(4)130)83(144)77(138)60(41-121)159-105)175-108-75(119-57(8)134)87(148)97(67(48-128)166-108)172-114-103(177-110-90(151)88(149)76(137)52(3)158-110)102(81(142)64(45-125)163-114)176-106-72(116-54(5)131)84(145)78(139)61(42-122)160-106/h37,39,52,58-69,71-114,121-129,135,137-155H,9-36,38,40-51H2,1-8H3,(H,115,130)(H,116,131)(H,117,132)(H,118,133)(H,119,134)(H,120,136)/b39-37+/t52?,58-,59+,60?,61?,62?,63?,64?,65?,66?,67?,68?,69?,71?,72?,73?,74?,75?,76+,77-,78-,79-,80-,81-,82-,83+,84+,85+,86+,87+,88?,89+,90-,91?,92?,93?,94?,95+,96+,97+,98+,99-,100-,101-,102-,103?,104+,105-,106-,107-,108-,109+,110+,111-,112-,113-,114-/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](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@H](O)[C@H](O)C7NC(C)=O)C6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@H](O)[C@H](O)C7NC(C)=O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph