NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM24620 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C101H177N5O52 charge 0 mass 2292.13596 reference lipidmapsM:LMSP0601EQ02 InChIKey QIAXTOOFOLRFDP-OSAABDSCSA-N InChI InChI=1S/C101H177N5O52/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-63(122)105-51(52(119)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2)46-141-95-80(135)78(133)87(61(44-114)149-95)154-97-81(136)89(71(126)56(39-109)144-97)155-93-67(103-49(4)117)75(130)85(59(42-112)147-93)152-98-82(137)90(73(128)62(150-98)47-142-92-66(102-48(3)116)74(129)84(58(41-111)146-92)151-96-79(134)77(132)70(125)55(38-108)143-96)156-94-68(104-50(5)118)76(131)86(60(43-113)148-94)153-99-83(138)91(72(127)57(40-110)145-99)158-101(100(139)140)36-53(120)65(106-64(123)45-115)88(157-101)69(124)54(121)37-107/h32,34,51-62,65-99,107-115,119-121,124-138H,6-31,33,35-47H2,1-5H3,(H,102,116)(H,103,117)(H,104,118)(H,105,122)(H,106,123)(H,139,140)/b34-32+/t51-,52+,53?,54+,55?,56?,57?,58?,59?,60?,61?,62?,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-,91-,92+,93-,94-,95+,96-,97-,98-,99-,101-/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]4OC(CO[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@]7(C(=O)O)CC(O)[C@@H](NC(=O)CO)C([C@H](O)[C@H](O)CO)O7)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph