Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-3(Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM25892 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C116H204N4O61 charge 0 mass 2629.29839 reference lipidmapsM:LMSP0505AT03 InChIKey RLGVILRESPRFGT-HOGAXEKCSA-N InChI InChI=1S/C116H204N4O61/c1-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-68(134)120-56(57(133)38-36-34-32-30-28-26-21-19-17-15-13-11-9-2)49-158-108-92(155)87(150)98(66(48-129)170-108)173-113-93(156)99(76(139)60(42-123)164-113)176-106-70(118-54(6)131)81(144)95(64(46-127)168-106)172-114-94(157)100(177-107-71(119-55(7)132)82(145)97(65(47-128)169-107)175-116-104(181-110-89(152)84(147)73(136)52(4)161-110)102(78(141)62(44-125)166-116)179-112-91(154)86(149)75(138)59(41-122)163-112)79(142)67(171-114)50-159-105-69(117-53(5)130)80(143)96(63(45-126)167-105)174-115-103(180-109-88(151)83(146)72(135)51(3)160-109)101(77(140)61(43-124)165-115)178-111-90(153)85(148)74(137)58(40-121)162-111/h36,38,51-52,56-67,69-116,121-129,133,135-157H,8-35,37,39-50H2,1-7H3,(H,117,130)(H,118,131)(H,119,132)(H,120,134)/b38-36+/t51?,52?,56-,57+,58?,59?,60?,61?,62?,63?,64?,65?,66?,67?,69?,70?,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-,115-,116-/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)C7O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[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)C7O)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