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

Properties Image Occurences in reactions MNX_ID MNXM28899 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C98H174N4O47 charge 0 mass 2159.13484 reference lipidmapsM:LMSP0504BA03 InChIKey MYGNQVXSCDZZTC-QJZFLXASSA-N InChI InChI=1S/C98H174N4O47/c1-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-62(114)102-52(53(113)37-35-33-31-29-27-25-20-18-16-14-12-10-8-2)46-132-93-80(129)77(126)84(60(45-109)141-93)144-96-81(130)87(71(120)58(43-107)138-96)147-91-64(100-50(5)111)85(69(118)56(41-105)135-91)145-97-82(131)88(72(121)61(142-97)47-133-90-63(99-49(4)110)73(122)83(59(44-108)140-90)143-95-79(128)75(124)67(116)54(39-103)137-95)148-92-65(101-51(6)112)86(70(119)57(42-106)136-92)146-98-89(76(125)68(117)55(40-104)139-98)149-94-78(127)74(123)66(115)48(3)134-94/h35,37,48,52-61,63-98,103-109,113,115-131H,7-34,36,38-47H2,1-6H3,(H,99,110)(H,100,111)(H,101,112)(H,102,114)/b37-35+/t48?,52-,53+,54?,55?,56?,57?,58?,59?,60?,61?,63?,64?,65?,66+,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-/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)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph