GalNAcalpha1-3GalNAcbeta1-3Galalpha1-3(GlcNAcbeta1-6)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM24895 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C84H150N4O33 charge 0 mass 1743.01823 reference lipidmapsM:LMSP0506AL07 InChIKey RZFUFVYNDKOKBP-PJXQGFAOSA-N InChI InChI=1S/C84H150N4O33/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-60(98)88-52(53(97)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)47-110-82-72(107)71(106)75(58(46-93)116-82)118-84-74(109)78(68(103)59(117-84)48-111-79-61(85-49(3)94)69(104)64(99)54(42-89)112-79)121-83-73(108)77(67(102)57(45-92)115-83)120-81-63(87-51(5)96)76(66(101)56(44-91)114-81)119-80-62(86-50(4)95)70(105)65(100)55(43-90)113-80/h20-21,38,40,52-59,61-84,89-93,97,99-109H,6-19,22-37,39,41-48H2,1-5H3,(H,85,94)(H,86,95)(H,87,96)(H,88,98)/b21-20-,40-38+/t52-,53+,54?,55?,56?,57?,58?,59?,61?,62?,63?,64+,65-,66-,67-,68-,69+,70+,71+,72?,73?,74?,75+,76+,77-,78-,79+,80+,81-,82+,83+,84-/m0/s1 SMILES CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3NC(C)=O)[C@H](O)[C@H](O[C@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@H]5OC(CO)[C@H](O)[C@H](O)C5NC(C)=O)C4NC(C)=O)C3O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph