trimeric LeY-9(d18:1/18:0)

Properties Image Occurences in reactions MNX_ID MNXM29162 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C94H167N3O45 charge 0 mass 2058.08716 reference lipidmapsM:LMSP0505BA02 InChIKey RWHODWBMORVYLI-AAOBHAPGSA-N InChI InChI=1S/C94H167N3O45/c1-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-58(107)97-50(51(106)36-34-32-30-28-26-24-21-19-17-15-13-11-9-2)44-125-88-75(122)71(118)78(55(41-101)134-88)135-92-76(123)83(65(112)53(39-99)129-92)140-86-59(95-48(6)104)81(138-89-72(119)67(114)61(108)45(3)126-89)79(56(42-102)132-86)136-93-77(124)84(66(113)54(40-100)130-93)141-87-60(96-49(7)105)82(139-90-73(120)68(115)62(109)46(4)127-90)80(57(43-103)133-87)137-94-85(70(117)64(111)52(38-98)131-94)142-91-74(121)69(116)63(110)47(5)128-91/h34,36,45-47,50-57,59-94,98-103,106,108-124H,8-33,35,37-44H2,1-7H3,(H,95,104)(H,96,105)(H,97,107)/b36-34+/t45?,46?,47?,50-,51+,52?,53?,54?,55?,56?,57?,59?,60?,61+,62+,63+,64-,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-/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](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)C5NC(C)=O)C4O)[C@H](O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph