glucosyl-glucosyl-galactosyl-glucosyl-inner core oligosaccharide lipid A

Properties Image Occurences in reactions MNX_ID MNXM738097 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 2 formula C169H291N2O94P4 charge -11 mass 3976.70629 reference metacycM:CPD0-2259 InChIKey UEXAUCWUYXEMND-VPWIFIFJSA-C InChI InChI=1S/C169H302N2O94P4/c1-8-14-20-26-32-38-39-45-51-57-63-69-112(192)239-93(67-61-55-49-43-36-30-24-18-12-5)73-114(194)247-147-116(171-110(190)72-92(66-60-54-48-42-35-29-23-17-11-4)238-111(191)68-62-56-50-44-37-31-25-19-13-6)154(234-86-106-122(200)146(246-113(193)71-91(181)65-59-53-47-41-34-28-22-16-10-3)115(155(243-106)265-269(230,231)232)170-109(189)70-90(180)64-58-52-46-40-33-27-21-15-9-2)245-108(145(147)262-266(221,222)223)88-236-167(164(215)216)76-102(258-169(166(219)220)75-101(121(199)138(259-169)96(184)78-173)257-168(165(217)218)74-94(182)139(142(261-168)98(186)80-175)249-158-132(210)124(202)117(195)89(7)237-158)144(143(260-167)99(187)81-176)252-161-135(213)149(152(263-267(224,225)226)140(250-161)97(185)79-174)255-162-136(214)150(153(264-268(227,228)229)141(251-162)100(188)85-233-157-131(209)127(205)129(207)137(248-157)95(183)77-172)254-160-134(212)148(123(201)107(244-160)87-235-156-130(208)125(203)118(196)103(82-177)240-156)253-163-151(128(206)120(198)105(84-179)242-163)256-159-133(211)126(204)119(197)104(83-178)241-159/h89-108,115-163,172-188,195-214H,8-88H2,1-7H3,(H,170,189)(H,171,190)(H,215,216)(H,217,218)(H,219,220)(H2,221,222,223)(H2,224,225,226)(H2,227,228,229)(H2,230,231,232)/p-11/t89-,90+,91+,92+,93+,94+,95-,96+,97+,98+,99+,100+,101+,102+,103+,104+,105+,106+,107+,108+,115+,116+,117-,118-,119+,120+,121+,122+,123+,124+,125-,126-,127-,128-,129-,130+,131-,132+,133+,134+,135-,136-,137+,138+,139+,140+,141+,142+,143+,144+,145+,146+,147+,148-,149+,150+,151+,152+,153+,154+,155+,156+,157-,158-,159-,160-,161+,162-,163-,167+,168+,169+/m0/s1 SMILES CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)O[C@H]1[C@H](OP(=O)([O-])[O-])[C@@H](CO[C@]2(C(=O)[O-])C[C@@H](O[C@]3(C(=O)[O-])C[C@@H](O[C@]4(C(=O)[O-])C[C@@H](O)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H]([C@H](O)CO)O4)[C@@H](O)[C@@H]([C@H](O)CO)O3)[C@@H](O[C@H]3O[C@H]([C@H](O)CO)[C@@H](OP(=O)([O-])[O-])[C@H](O[C@@H]4O[C@H]([C@H](O)CO[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](OP(=O)([O-])[O-])[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@@H]([C@H](O)CO)O2)O[C@@H](OC[C@H]2O[C@H](OP(=O)([O-])[O-])[C@H](NC(=O)C[C@H](O)CCCCCCCCCCC)[C@@H](OC(=O)C[C@H](O)CCCCCCCCCCC)[C@@H]2O)[C@@H]1NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph