Fucalpha1-2(GalNAcalpha1-3)Galbeta1-4GlcNAcbeta1-3(Fucalpha1-2Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM22664 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C116H205N5O56 charge 0 mass 2564.33472 reference lipidmapsM:LMSP0505DX05 InChIKey MYMVQRVJTHRCKD-PDEAQPHESA-N InChI InChI=1S/C116H205N5O56/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-72(135)121-61(62(134)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2)53-156-110-94(153)91(150)100(70(52-129)167-110)170-113-95(154)101(81(140)65(47-124)161-113)173-108-75(119-59(7)132)86(145)97(68(50-127)165-108)169-114-96(155)102(83(142)71(168-114)54-157-106-74(118-58(6)131)85(144)98(67(49-126)164-106)171-115-104(90(149)80(139)64(46-123)162-115)176-111-92(151)88(147)77(136)55(3)158-111)174-109-76(120-60(8)133)87(146)99(69(51-128)166-109)172-116-105(177-112-93(152)89(148)78(137)56(4)159-112)103(82(141)66(48-125)163-116)175-107-73(117-57(5)130)84(143)79(138)63(45-122)160-107/h41,43,55-56,61-71,73-116,122-129,134,136-155H,9-40,42,44-54H2,1-8H3,(H,117,130)(H,118,131)(H,119,132)(H,120,133)(H,121,135)/b43-41+/t55?,56?,61-,62+,63?,64?,65?,66?,67?,68?,69?,70?,71?,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)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)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)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph