Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-3(Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM27170 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C122H216N4O61 charge 0 mass 2713.39229 reference lipidmapsM:LMSP0505AT06 InChIKey IUIXJWNJZVNSMZ-COLWIQBUSA-N InChI InChI=1S/C122H216N4O61/c1-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-33-35-37-39-41-43-45-74(140)126-62(63(139)44-42-40-38-36-34-32-21-19-17-15-13-11-9-2)55-164-114-98(161)93(156)104(72(54-135)176-114)179-119-99(162)105(82(145)66(48-129)170-119)182-112-76(124-60(6)137)87(150)101(70(52-133)174-112)178-120-100(163)106(183-113-77(125-61(7)138)88(151)103(71(53-134)175-113)181-122-110(187-116-95(158)90(153)79(142)58(4)167-116)108(84(147)68(50-131)172-122)185-118-97(160)92(155)81(144)65(47-128)169-118)85(148)73(177-120)56-165-111-75(123-59(5)136)86(149)102(69(51-132)173-111)180-121-109(186-115-94(157)89(152)78(141)57(3)166-115)107(83(146)67(49-130)171-121)184-117-96(159)91(154)80(143)64(46-127)168-117/h42,44,57-58,62-73,75-122,127-135,139,141-163H,8-41,43,45-56H2,1-7H3,(H,123,136)(H,124,137)(H,125,138)(H,126,140)/b44-42+/t57?,58?,62-,63+,64?,65?,66?,67?,68?,69?,70?,71?,72?,73?,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+,117-,118+,119-,120-,121-,122-/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)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph