GalNAcalpha1-3(Fucalpha1-2)Galbeta1-3GlcNAcbeta1-3(GalNAcalpha1-3(Fucalpha1-2)Galbeta1-3GlcNAcbeta1-6)Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM25525 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C126H222N6O61 charge 0 mass 2795.44539 reference lipidmapsM:LMSP0504BO06 InChIKey HAKVFRXNNBREER-KRENVSIVSA-N InChI InChI=1S/C126H222N6O61/c1-10-12-14-16-18-20-22-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-78(148)132-66(67(147)46-44-42-40-38-36-34-23-21-19-17-15-13-11-2)57-170-120-102(167)99(164)105(76(56-141)182-120)184-123-103(168)109(91(156)73(53-138)179-123)188-118-82(130-64(8)145)107(89(154)71(51-136)177-118)185-124-104(169)110(189-119-83(131-65(9)146)108(90(155)72(52-137)178-119)187-126-114(193-122-101(166)98(163)85(150)60(4)173-122)112(93(158)75(55-140)181-126)191-117-80(128-62(6)143)96(161)87(152)69(49-134)176-117)94(159)77(183-124)58-171-115-81(129-63(7)144)106(88(153)70(50-135)174-115)186-125-113(192-121-100(165)97(162)84(149)59(3)172-121)111(92(157)74(54-139)180-125)190-116-79(127-61(5)142)95(160)86(151)68(48-133)175-116/h44,46,59-60,66-77,79-126,133-141,147,149-169H,10-43,45,47-58H2,1-9H3,(H,127,142)(H,128,143)(H,129,144)(H,130,145)(H,131,146)(H,132,148)/b46-44+/t59?,60?,66-,67+,68?,69?,70?,71?,72?,73?,74?,75?,76?,77?,79?,80?,81?,82?,83?,84+,85+,86-,87-,88+,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?,114?,115+,116-,117+,118-,119-,120+,121+,122+,123-,124-,125-,126-/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](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]6OC(C)[C@@H](O)C(O)[C@@H]6O)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[C@H]7OC(CO)[C@H](O)[C@H](O)C7NC(C)=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)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph