NeuAcalpha2-3Galbeta1-4GlcNAcbeta1-6(NeuAcbeta2-3Galbeta1-4GlcNAcbeta1-3)Galbeta1-4GlcNAcbeta1-6(NeuAcbeta2-3Galbeta1-4GlcNAcbeta1-3)Galbeta1-4GlcNAcbeta1-6(NeuAcbeta2-3Galbeta1-4GlcNAcbeta1-3)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

Properties Image Occurences in reactions MNX_ID MNXM25421 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C198H334N12O115 charge 0 mass 4720.06563 reference lipidmapsM:LMSP0601GD08 InChIKey ZLDRAPOIAINTSD-CTDQEJRGSA-N InChI InChI=1S/C198H334N12O115/c1-14-16-18-20-22-24-26-28-29-30-31-32-33-34-35-36-37-39-41-43-45-47-49-51-114(248)210-88(89(239)50-48-46-44-42-40-38-27-25-23-21-19-17-15-2)73-286-182-146(269)145(268)162(110(72-227)302-182)313-183-147(270)167(130(253)98(60-215)290-183)314-178-122(206-84(10)235)141(264)158(106(68-223)298-178)308-186-150(273)170(317-181-125(209-87(13)238)144(267)161(109(71-226)301-181)312-190-154(277)174(134(257)102(64-219)294-190)325-198(194(284)285)55-93(243)118(202-80(6)231)166(321-198)129(252)97(247)59-214)137(260)113(305-186)76-288-176-120(204-82(8)233)139(262)156(104(66-221)296-176)306-184-148(271)168(315-179-123(207-85(11)236)142(265)159(107(69-224)299-179)310-188-152(275)172(132(255)100(62-217)292-188)323-196(192(280)281)53-91(241)116(200-78(4)229)164(319-196)127(250)95(245)57-212)135(258)111(303-184)74-287-175-119(203-81(7)232)138(261)155(103(65-220)295-175)307-185-149(272)169(316-180-124(208-86(12)237)143(266)160(108(70-225)300-180)311-189-153(276)173(133(256)101(63-218)293-189)324-197(193(282)283)54-92(242)117(201-79(5)230)165(320-197)128(251)96(246)58-213)136(259)112(304-185)75-289-177-121(205-83(9)234)140(263)157(105(67-222)297-177)309-187-151(274)171(131(254)99(61-216)291-187)322-195(191(278)279)52-90(240)115(199-77(3)228)163(318-195)126(249)94(244)56-211/h28-29,48,50,88-113,115-190,211-227,239-247,249-277H,14-27,30-47,49,51-76H2,1-13H3,(H,199,228)(H,200,229)(H,201,230)(H,202,231)(H,203,232)(H,204,233)(H,205,234)(H,206,235)(H,207,236)(H,208,237)(H,209,238)(H,210,248)(H,278,279)(H,280,281)(H,282,283)(H,284,285)/b29-28-,50-48+/t88-,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?,115+,116+,117+,118+,119?,120?,121?,122?,123?,124?,125?,126+,127+,128+,129+,130-,131-,132-,133-,134-,135-,136-,137-,138+,139+,140+,141+,142+,143+,144+,145+,146?,147?,148?,149?,150?,151?,152?,153?,154?,155+,156+,157+,158+,159+,160+,161+,162+,163?,164?,165?,166?,167-,168-,169-,170-,171-,172-,173-,174-,175+,176+,177+,178-,179-,180-,181-,182+,183-,184-,185-,186-,187-,188-,189-,190-,195-,196-,197-,198-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)N[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]7OC(CO)[C@@H](O[C@@H]8OC(CO[C@@H]9OC(CO)[C@@H](O[C@@H]%10OC(CO)[C@H](O)[C@H](O[C@]%11(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O%11)C%10O)[C@H](O)C9NC(C)=O)[C@H](O)[C@H](O[C@@H]9OC(CO)[C@@H](O[C@@H]%10OC(CO)[C@H](O)[C@H](O[C@]%11(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O%11)C%10O)[C@H](O)C9NC(C)=O)C8O)[C@H](O)C7NC(C)=O)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@@H](O[C@@H]8OC(CO)[C@H](O)[C@H](O[C@]9(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O9)C8O)[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[C@]7(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O7)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph