Fucalpha1-2Galbeta1-4GlcNAcbeta1-3(GalNAcalpha1-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/16:0)

Properties Image Occurences in reactions MNX_ID MNXM22954 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C102H179N5O52 charge 0 mass 2306.15161 reference lipidmapsM:LMSP0505EG01 InChIKey MTRIWPWALDTYJZ-QNWMTFDCSA-N InChI InChI=1S/C102H179N5O52/c1-8-10-12-14-16-18-20-22-24-26-28-30-32-34-52(120)51(107-62(121)35-33-31-29-27-25-23-21-19-17-15-13-11-9-2)44-140-97-81(136)79(134)88(60(43-115)150-97)154-100-83(138)90(71(126)56(39-111)145-100)157-95-65(105-49(6)118)75(130)86(58(41-113)148-95)153-101-84(139)91(158-96-66(106-50(7)119)76(131)87(59(42-114)149-96)155-102-92(78(133)69(124)54(37-109)146-102)159-98-80(135)77(132)67(122)46(3)142-98)72(127)61(151-101)45-141-93-64(104-48(5)117)74(129)85(57(40-112)147-93)152-99-82(137)89(70(125)55(38-110)144-99)156-94-63(103-47(4)116)73(128)68(123)53(36-108)143-94/h32,34,46,51-61,63-102,108-115,120,122-139H,8-31,33,35-45H2,1-7H3,(H,103,116)(H,104,117)(H,105,118)(H,106,119)(H,107,121)/b34-32+/t46?,51-,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+,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]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)C7NC(C)=O)C6O)[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)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)CCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph