Galbeta1-4GlcNAcbeta1-3(Galalpha1-3Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))

Properties Image Occurences in reactions MNX_ID MNXM28679 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C102H180N4O48 charge 0 mass 2229.1767 reference lipidmapsM:LMSP0505BO07 InChIKey QLDJWEVHAVSHFI-SONGXVOISA-N InChI InChI=1S/C102H180N4O48/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-66(119)106-55(56(118)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)50-137-97-83(133)80(130)90(64(49-114)146-97)151-101-84(134)91(72(122)59(44-109)142-101)152-95-69(105-54(5)117)77(127)89(63(48-113)145-95)150-102-86(136)93(153-96-68(104-53(4)116)76(126)88(62(47-112)144-96)148-98-81(131)78(128)70(120)57(42-107)139-98)74(124)65(147-102)51-138-94-67(103-52(3)115)75(125)87(61(46-111)143-94)149-100-85(135)92(73(123)60(45-110)141-100)154-99-82(132)79(129)71(121)58(43-108)140-99/h20-21,38,40,55-65,67-102,107-114,118,120-136H,6-19,22-37,39,41-51H2,1-5H3,(H,103,115)(H,104,116)(H,105,117)(H,106,119)/b21-20-,40-38+/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-,93-,94+,95-,96-,97+,98-,99-,100-,101-,102-/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]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)C7O)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)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