GalNAcbeta1-3(Galbeta1-3GalNAcbeta1-4)Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM24028 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C78H141N3O33 charge 0 mass 1647.94473 reference lipidmapsM:LMSP0502BL03 InChIKey FTZUVGLXZBPHRD-ZEXFXNMZSA-N InChI InChI=1S/C78H141N3O33/c1-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-54(91)81-46(47(90)35-33-31-29-27-25-23-18-16-14-12-10-8-6-2)43-103-75-65(100)62(97)68(51(40-85)107-75)110-77-66(101)63(98)69(52(41-86)108-77)111-78-67(102)72(114-73-55(79-44(3)88)60(95)57(92)48(37-82)104-73)70(53(42-87)109-78)112-74-56(80-45(4)89)71(59(94)50(39-84)105-74)113-76-64(99)61(96)58(93)49(38-83)106-76/h33,35,46-53,55-78,82-87,90,92-102H,5-32,34,36-43H2,1-4H3,(H,79,88)(H,80,89)(H,81,91)/b35-33+/t46-,47+,48?,49?,50?,51?,52?,53?,55?,56?,57-,58-,59-,60+,61-,62+,63+,64?,65?,66?,67?,68+,69-,70-,71+,72+,73-,74-,75+,76-,77-,78-/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]3OC(CO)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O)C5O)C4NC(C)=O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph