Galalpha1-3(Fucalpha1-2)Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM30019 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C102H180N4O48 charge 0 mass 2229.1767 reference lipidmapsM:LMSP0601CM05 InChIKey CHAAXGOCRQJPMH-SEXIEHNLSA-N InChI InChI=1S/C102H180N4O48/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-68(121)106-57(58(117)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)52-139-94-83(133)80(130)85(66(50-112)144-94)146-97-84(134)91(154-102(100(137)138)44-60(119)70(104-55(5)115)89(153-102)77(127)65(49-111)151-101(99(135)136)43-59(118)69(103-54(4)114)88(152-101)73(123)61(120)45-107)86(67(51-113)145-97)147-93-71(105-56(6)116)87(75(125)63(47-109)141-93)148-98-92(150-95-81(131)78(128)72(122)53(3)140-95)90(76(126)64(48-110)143-98)149-96-82(132)79(129)74(124)62(46-108)142-96/h39,41,53,57-67,69-98,107-113,117-120,122-134H,7-38,40,42-52H2,1-6H3,(H,103,114)(H,104,115)(H,105,116)(H,106,121)(H,135,136)(H,137,138)/b41-39+/t53?,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-,101+,102-/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]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@H]5OC(CO)[C@H](O)[C@H](O)C5O)C4O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@@H](CO)O[C@]4(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O4)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph