NeuAcalpha2-6(NeuAcalpha2-3)Galbeta1-3GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/24:0)

Properties Image Occurences in reactions MNX_ID MNXM1103050 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C96H170N4O44 charge 0 mass 2083.11879 reference lipidmapsM:LMSP0601AD05 InChIKey CSWMRLBYYWUBGP-PLAZZGQYSA-N InChI InChI=1S/C96H170N4O44/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-66(115)100-55(56(110)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)50-131-89-77(123)75(121)81(63(48-105)135-89)138-90-78(124)76(122)82(64(49-106)136-90)139-91-79(125)86(73(119)62(47-104)134-91)141-88-69(99-54(5)109)83(72(118)61(46-103)133-88)140-92-80(126)87(144-96(94(129)130)43-58(112)68(98-53(4)108)85(143-96)71(117)60(114)45-102)74(120)65(137-92)51-132-95(93(127)128)42-57(111)67(97-52(3)107)84(142-95)70(116)59(113)44-101/h38,40,55-65,67-92,101-106,110-114,116-126H,6-37,39,41-51H2,1-5H3,(H,97,107)(H,98,108)(H,99,109)(H,100,115)(H,127,128)(H,129,130)/b40-38+/t55-,56+,57?,58?,59+,60+,61?,62?,63?,64?,65?,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-,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]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO[C@]6(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O6)[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)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph