CHEBI:89981 - LPS with O-antigen

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ChEBI Name LPS with O-antigen ChEBI ID CHEBI:89981 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C211H376N8O126P6 Net Charge 0 Average Mass 5227.072 Monoisotopic Mass 5224.16862 InChI InChI=1S/C211H376N8O126P6/c1-11-17-23-29-35-41-42-48-54-60-66-72-134(247)308-109(70-64-58-52-46-39-33-27-21-15-5)80-136(249)322-182-142(219-132(245)79-108(69-63-57-51-45-38-32-26-20-14-4)307-133(246)71-65-59-53-47-40-34-28-22-16-6)192(301-99-128-153(260)179(321-135(248)78-107(237)68-62-56-50-44-37-31-25-19-13-3)141(196(317-128)344-348(290,291)292)218-131(244)77-106(236)67-61-55-49-43-36-30-24-18-12-2)320-130(178(182)341-346(284,285)286)101-304-209(206(278)279)83-118(336-210(207(280)281)81-116(149(256)172(337-210)110(238)84-220)335-211(208(282)283)82-117(340-349(293,294)305-75-73-212)150(257)173(338-211)111(239)85-221)177(176(339-209)114(242)88-224)326-203-170(277)186(189(175(325-203)113(241)87-223)343-351(297,298)345-350(295,296)306-76-74-213)332-202-169(276)184(167(274)171(323-202)115(243)96-299-199-166(273)162(269)187(342-347(287,288)289)174(324-199)112(240)86-222)329-201-168(275)183(155(262)129(319-201)100-303-198-164(271)159(266)146(253)122(92-228)313-198)330-204-188(161(268)147(254)123(93-229)314-204)333-205-190(334-193-138(215-103(8)233)157(264)144(251)120(90-226)310-193)185(152(259)125(95-231)315-205)331-195-140(217-105(10)235)181(154(261)127(316-195)98-300-191-137(214-102(7)232)156(263)143(250)119(89-225)309-191)327-194-139(216-104(9)234)180(151(258)124(94-230)311-194)328-200-165(272)160(267)148(255)126(318-200)97-302-197-163(270)158(265)145(252)121(91-227)312-197/h106-130,137-205,220-231,236-243,250-277H,11-101,212-213H2,1-10H3,(H,214,232)(H,215,233)(H,216,234)(H,217,235)(H,218,244)(H,219,245)(H,278,279)(H,280,281)(H,282,283)(H,293,294)(H,295,296)(H,297,298)(H2,284,285,286)(H2,287,288,289)(H2,290,291,292)/t106-,107-,108-,109-,110+,111+,112+,113+,114+,115+,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,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-,164-,165-,166+,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?,209-,210-,211-/m1/s1 InChIKey BFVQTKQTUCQRPI-YYEZTRBPSA-N SMILES C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](C(O[C@@H]([C@H]2O)CO)O[C@H]3[C@H](O[C@@H]([C@@H]([C@@H]3O)O)CO)O[C@@H]4[C@H](C(O[C@@H]([C@H]4O)CO[C@@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)O[C@@H]6[C@@H](C(O[C@@H]([C@H]6O)[C@H](COC7[C@H]([C@H]([C@@H]([C@H](O7)[C@H](CO)O)OP(=O)(O)O)O)O)O)O[C@@H]8[C@@H](C(O[C@@H]([C@H]8OP(=O)(OP(=O)(O)OCCN)O)[C@H](CO)O)O[C@H]9[C@@H](C[C@@](O[C@@H]9[C@H](CO)O)(C(O)=O)OC[C@@H]%10[C@@H](OP(=O)(O)O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)[C@@H](NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)[C@@H](O%10)OC[C@@H]%11[C@H]([C@@H]([C@H]([C@H](O%11)OP(=O)(O)O)NC(=O)C[C@@H](CCCCCCCCCCC)O)OC(=O)C[C@@H](CCCCCCCCCCC)O)O)O[C@@]%12(C[C@H]([C@@H]([C@H](O%12)[C@H](CO)O)O)O[C@@]%13(C[C@H]([C@@H]([C@H](O%13)[C@H](CO)O)O)OP(=O)(OCCN)O)C(O)=O)C(O)=O)O)O)O)O[C@H]%14[C@@H]([C@H]([C@@H]([C@H](O%14)CO)O)O)NC(C)=O)NC(C)=O)O[C@H]%15[C@@H]([C@H]([C@H]([C@@H](CO)O%15)O)O[C@@H]%16[C@@H]([C@H]([C@H]([C@H](O%16)CO[C@@H]%17[C@@H]([C@H]([C@H]([C@H](O%17)CO)O)O)O)O)O)O)NC(C)=O)O)O[C@H]%18[C@@H]([C@H]([C@@H]([C@H](O%18)CO)O)O)NC(C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed ChEBI Ontology Outgoing LPS with O-antigen (CHEBI:89981) is a polysaccharide (CHEBI:18154) Synonyms Sources Endotoxin HMDB Endotoxin Lipopolysaccharide HMDB Endotoxin LPS HMDB Lipopolysaccharide HMDB Lipopolysaccharide with O-antigen HMDB LPS HMDB Manual Xrefs Databases CPD0-2294 MetaCyc HMDB0013470 HMDB Lipopolysaccharide Wikipedia View more database links Citation Type Source 14754910 PubMed citation Europe PMC