NeuAcalpha2-3Galbeta1-3Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM26383 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C79H141N3O36 charge 0 mass 1707.92948 reference lipidmapsM:LMSP0601DV02 InChIKey UNYCPTAUMYLOPO-GEHQEQPRSA-N InChI InChI=1S/C79H141N3O36/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-54(94)82-45(46(91)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2)42-107-74-63(101)62(100)67(53(41-88)112-74)113-75-64(102)70(59(97)50(38-85)109-75)115-73-56(81-44(4)90)68(58(96)49(37-84)108-73)114-76-65(103)71(60(98)51(39-86)110-76)116-77-66(104)72(61(99)52(40-87)111-77)118-79(78(105)106)35-47(92)55(80-43(3)89)69(117-79)57(95)48(93)36-83/h31,33,45-53,55-77,83-88,91-93,95-104H,5-30,32,34-42H2,1-4H3,(H,80,89)(H,81,90)(H,82,94)(H,105,106)/b33-31+/t45-,46+,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-,79-/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](O)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O[C@]6(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O6)C5O)C4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph