(O16 antigen)x4 core oligosaccharide lipid A

Properties Image Occurences in reactions MNX_ID MNXM91789 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 4 formula C298H502N6O189P4 charge -10 mass 7312.88601 reference seedM:cpd15518 InChIKey AVXFXMNEYSZWON-ORYYFELFSA-D InChI InChI=1S/C298H512N6O189P4/c1-19-25-31-37-43-49-50-56-62-68-74-80-164(344)441-130(78-72-66-60-54-47-41-35-29-23-5)84-166(346)461-247-172(304-162(342)83-129(77-71-65-59-53-46-40-34-28-22-4)440-163(343)79-73-67-61-55-48-42-36-30-24-6)265(420-107-157-188(362)242(460-165(345)82-128(329)76-70-64-58-52-45-39-33-27-21-3)171(270(452-157)493-497(416,417)418)303-161(341)81-127(328)75-69-63-57-51-44-38-32-26-20-2)458-160(241(247)490-494(407,408)409)114-431-297(295(403)404)86-142(487-298(296(405)406)85-131(330)177(351)235(488-298)138(337)93-311)240(238(489-297)140(339)95-313)471-285-227(401)253(259(491-495(410,411)412)236(468-285)139(338)94-312)482-286-228(402)254(260(492-496(413,414)415)237(469-286)141(340)102-419-276-215(389)203(377)206(380)229(462-276)132(331)87-305)481-284-226(400)248(193(367)158(457-284)112-425-275-214(388)198(372)182(356)147(100-318)446-275)476-290-255(205(379)183(357)148(101-319)447-290)486-283-222(396)209(383)239(159(459-283)113-427-277-216(390)204(378)207(381)230(463-277)133(332)88-306)470-266-167(299-119(11)320)243(189(363)153(448-266)108-421-271-210(384)194(368)178(352)143(96-314)442-271)472-291-261(436-123(15)324)250(174(348)115(7)432-291)478-280-218(392)200(374)185(359)150(454-280)104-428-287-257(224(398)233(465-287)136(335)91-309)484-268-169(301-121(13)322)245(191(365)155(450-268)110-423-273-212(386)196(370)180(354)145(98-316)444-273)474-293-263(438-125(17)326)252(176(350)117(9)434-293)480-282-220(394)202(376)187(361)152(456-282)106-430-289-258(225(399)234(467-289)137(336)92-310)485-269-170(302-122(14)323)246(192(366)156(451-269)111-424-274-213(387)197(371)181(355)146(99-317)445-274)475-294-264(439-126(18)327)251(175(349)118(10)435-294)479-281-219(393)201(375)186(360)151(455-281)105-429-288-256(223(397)232(466-288)135(334)90-308)483-267-168(300-120(12)321)244(190(364)154(449-267)109-422-272-211(385)195(369)179(353)144(97-315)443-272)473-292-262(437-124(16)325)249(173(347)116(8)433-292)477-279-217(391)199(373)184(358)149(453-279)103-426-278-221(395)208(382)231(464-278)134(333)89-307/h115-118,127-160,167-294,305-319,328-340,347-402H,19-114H2,1-18H3,(H,299,320)(H,300,321)(H,301,322)(H,302,323)(H,303,341)(H,304,342)(H,403,404)(H,405,406)(H2,407,408,409)(H2,410,411,412)(H2,413,414,415)(H2,416,417,418)/p-10/t115-,116-,117-,118-,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+,167+,168+,169+,170+,171+,172+,173-,174-,175-,176-,177+,178+,179+,180+,181+,182-,183+,184+,185+,186+,187+,188+,189+,190+,191+,192+,193+,194-,195-,196-,197-,198-,199-,200-,201-,202-,203-,204-,205-,206-,207-,208+,209+,210+,211+,212+,213+,214+,215-,216-,217+,218+,219+,220+,221+,222+,223-,224-,225-,226+,227-,228-,229+,230?,231-,232-,233-,234-,235+,236+,237+,238+,239+,240+,241+,242+,243+,244+,245+,246+,247+,248-,249+,250+,251+,252+,253+,254+,255+,256+,257+,258+,259+,260+,261+,262+,263+,264+,265+,266+,267+,268+,269+,270+,271-,272-,273-,274-,275-,276-,277-,278+,279+,280+,281+,282+,283+,284+,285+,286-,287+,288+,289+,290+,291-,292-,293-,294-,297+,298+/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@@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]7OC([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]7O)[C@@H](O[C@H]7O[C@H](CO[C@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@H]9O[C@H](CO[C@@H]%10O[C@@H]([C@H](O)CO)[C@H](O)[C@H]%10O[C@H]%10O[C@H](CO[C@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)[C@@H](O)[C@H](O[C@@H]%11O[C@@H](C)[C@H](O)[C@@H](O[C@H]%12O[C@H](CO[C@@H]%13O[C@@H]([C@H](O)CO)[C@H](O)[C@H]%13O[C@H]%13O[C@H](CO[C@H]%14O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%14O)[C@@H](O)[C@H](O[C@@H]%14O[C@@H](C)[C@H](O)[C@@H](O[C@H]%15O[C@H](CO[C@@H]%16O[C@@H]([C@H](O)CO)[C@H](O)[C@H]%16O[C@H]%16O[C@H](CO[C@H]%17O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%17O)[C@@H](O)[C@H](O[C@@H]%17O[C@@H](C)[C@H](O)[C@@H](O[C@H]%18O[C@H](CO[C@@H]%19O[C@@H]([C@H](O)CO)[C@H](O)[C@H]%19O)[C@@H](O)[C@H](O)[C@H]%18O)[C@H]%17OC(C)=O)[C@H]%16NC(C)=O)[C@@H](O)[C@H](O)[C@H]%15O)[C@H]%14OC(C)=O)[C@H]%13NC(C)=O)[C@@H](O)[C@H](O)[C@H]%12O)[C@H]%11OC(C)=O)[C@H]%10NC(C)=O)[C@@H](O)[C@H](O)[C@H]9O)[C@H]8OC(C)=O)[C@H]7NC(C)=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