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

Properties Image Occurences in reactions MNX_ID MNXM28290 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C90H160N4O38 charge 0 mass 1905.07106 reference lipidmapsM:LMSP0505BF07 InChIKey SRMAARAIEMQXEU-FXDXXHRISA-N InChI InChI=1S/C90H160N4O38/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-62(106)94-53(54(105)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)49-119-87-74(115)73(114)80(61(48-101)126-87)129-90-77(118)83(69(110)58(45-98)123-90)132-86-65(93-52(5)104)72(113)79(60(47-100)125-86)128-89-76(117)82(68(109)57(44-97)122-89)131-85-64(92-51(4)103)71(112)78(59(46-99)124-85)127-88-75(116)81(67(108)56(43-96)121-88)130-84-63(91-50(3)102)70(111)66(107)55(42-95)120-84/h20-21,38,40,53-61,63-90,95-101,105,107-118H,6-19,22-37,39,41-49H2,1-5H3,(H,91,102)(H,92,103)(H,93,104)(H,94,106)/b21-20-,40-38+/t53-,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-/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](O)[C@H](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[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)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