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

Properties Image Occurences in reactions MNX_ID MNXM29122 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C102H182N4O47 charge 0 mass 2215.19744 reference lipidmapsM:LMSP0504BA05 InChIKey INSVJIYWQYMXCM-XHXNTEOJSA-N InChI InChI=1S/C102H182N4O47/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-66(118)106-56(57(117)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)50-136-97-84(133)81(130)88(64(49-113)145-97)148-100-85(134)91(75(124)62(47-111)142-100)151-95-68(104-54(5)115)89(73(122)60(45-109)139-95)149-101-86(135)92(76(125)65(146-101)51-137-94-67(103-53(4)114)77(126)87(63(48-112)144-94)147-99-83(132)79(128)71(120)58(43-107)141-99)152-96-69(105-55(6)116)90(74(123)61(46-110)140-96)150-102-93(80(129)72(121)59(44-108)143-102)153-98-82(131)78(127)70(119)52(3)138-98/h39,41,52,56-65,67-102,107-113,117,119-135H,7-38,40,42-51H2,1-6H3,(H,103,114)(H,104,115)(H,105,116)(H,106,118)/b41-39+/t52?,56-,57+,58?,59?,60?,61?,62?,63?,64?,65?,67?,68?,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-/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](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](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O)[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)C5NC(C)=O)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph