trimeric LeY-9(d18:1/20:0)

Properties Image Occurences in reactions MNX_ID MNXM24926 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C96H171N3O45 charge 0 mass 2086.11846 reference lipidmapsM:LMSP0505BA03 InChIKey FLZHXLPJBPYUGD-MQRFOYRSSA-N InChI InChI=1S/C96H171N3O45/c1-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-60(109)99-52(53(108)38-36-34-32-30-28-26-21-19-17-15-13-11-9-2)46-127-90-77(124)73(120)80(57(43-103)136-90)137-94-78(125)85(67(114)55(41-101)131-94)142-88-61(97-50(6)106)83(140-91-74(121)69(116)63(110)47(3)128-91)81(58(44-104)134-88)138-95-79(126)86(68(115)56(42-102)132-95)143-89-62(98-51(7)107)84(141-92-75(122)70(117)64(111)48(4)129-92)82(59(45-105)135-89)139-96-87(72(119)66(113)54(40-100)133-96)144-93-76(123)71(118)65(112)49(5)130-93/h36,38,47-49,52-59,61-96,100-105,108,110-126H,8-35,37,39-46H2,1-7H3,(H,97,106)(H,98,107)(H,99,109)/b38-36+/t47?,48?,49?,52-,53+,54?,55?,56?,57?,58?,59?,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-,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](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)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph