type II B antigen(d18:1/26:0)

Properties Image Occurences in reactions MNX_ID MNXM24950 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C96H173N3O42 charge 0 mass 2040.14937 reference lipidmapsM:LMSP0505AO06 InChIKey DNKNYUXXKMQGBF-MBXQOPCRSA-N InChI InChI=1S/C96H173N3O42/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-64(110)99-55(56(109)42-40-38-36-34-32-30-19-17-15-13-11-9-7-2)51-126-91-79(123)76(120)84(63(50-106)134-91)136-95-81(125)86(70(114)59(46-102)130-95)139-89-65(97-53(4)107)72(116)82(61(48-104)132-89)135-94-80(124)85(69(113)58(45-101)129-94)138-90-66(98-54(5)108)73(117)83(62(49-105)133-90)137-96-88(141-92-77(121)74(118)67(111)52(3)127-92)87(71(115)60(47-103)131-96)140-93-78(122)75(119)68(112)57(44-100)128-93/h40,42,52,55-63,65-96,100-106,109,111-125H,6-39,41,43-51H2,1-5H3,(H,97,107)(H,98,108)(H,99,110)/b42-40+/t52?,55-,56+,57?,58?,59?,60?,61?,62?,63?,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[C@H]7OC(CO)[C@H](O)[C@H](O)C7O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph