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

Properties Image Occurences in reactions MNX_ID MNXM22712 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C96H173N3O41 charge 0 mass 2024.15445 reference lipidmapsM:LMSP0504BT06 InChIKey UMPSTWDGXVPKKD-SZDJCTMVSA-N InChI InChI=1S/C96H173N3O41/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-64(109)99-56(57(108)43-41-39-37-35-33-31-20-18-16-14-12-10-8-2)51-125-91-79(122)75(118)82(61(48-103)133-91)134-95-80(123)87(70(113)59(46-101)129-95)139-90-66(98-55(6)107)86(84(63(50-105)132-90)136-93-77(120)73(116)68(111)53(4)127-93)138-96-81(124)88(71(114)60(47-102)130-96)140-89-65(97-54(5)106)85(137-94-78(121)74(117)69(112)58(45-100)128-94)83(62(49-104)131-89)135-92-76(119)72(115)67(110)52(3)126-92/h41,43,52-53,56-63,65-96,100-105,108,110-124H,7-40,42,44-51H2,1-6H3,(H,97,106)(H,98,107)(H,99,109)/b43-41+/t52?,53?,56-,57+,58?,59?,60?,61?,62?,63?,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-/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(C)[C@@H](O)C(O)[C@@H]4O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O)C5NC(C)=O)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph