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Glucosyl-inner core oligosaccharide lipid A

MNXM55194 is deprecated and here replaced by MNXM738099
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM738099Image of MNXM738099
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
formulaC151H265N2O79P4
charge-7
mass3494.57692
referencebiggM:gicolipa
InChIKeyJIYBFSMTJJSDHN-UHFFFAOYSA-G
InChIInChI=1S/C151H272N2O79P4/c1-8-14-20-26-32-38-39-45-51-57-63-69-106(172)211-90(67-61-55-49-43-36-30-24-18-12-5)73-108(174)216-134-110(153-104(170)72-89(66-60-54-48-42-35-29-23-17-11-4)210-105(171)68-62-56-50-44-37-31-25-19-13-6)139(207-84-101-114(178)133(215-107(173)71-88(161)65-59-53-47-41-34-28-22-16-10-3)109(140(213-101)232-236(203,204)205)152-103(169)70-87(160)64-58-52-46-40-33-27-21-15-9-2)214-102(132(134)229-233(194,195)196)85-208-149(146(188)189)75-98(225-151(148(192)193)76-99(224-150(147(190)191)74-91(162)112(176)125(226-150)93(164)78-155)131(129(228-151)96(167)81-158)220-142-120(184)115(179)111(175)86(7)209-142)130(128(227-149)95(166)80-157)221-144-122(186)135(137(230-234(197,198)199)126(218-144)94(165)79-156)223-145-123(187)136(222-143-121(185)116(180)113(177)100(82-159)212-143)138(231-235(200,201)202)127(219-145)97(168)83-206-141-119(183)117(181)118(182)124(217-141)92(163)77-154/h86-102,109-145,154-168,175-187H,8-85H2,1-7H3,(H,152,169)(H,153,170)(H,188,189)(H,190,191)(H,192,193)(H2,194,195,196)(H2,197,198,199)(H2,200,201,202)(H2,203,204,205)/p-7
SMILESCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)C(OCC2OC(OP(=O)([O-])O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)C2O)OC(COC2(C(=O)[O-])CC(OC3(C(=O)[O-])CC(OC4(C(=O)[O-])CC(O)C(O)C(C(O)CO)O4)C(OC4OC(C)C(O)C(O)C4O)C(C(O)CO)O3)C(OC3OC(C(O)CO)C(OP(=O)([O-])O)C(OC4OC(C(O)COC5OC(C(O)CO)C(O)C(O)C5O)C(OP(=O)([O-])O)C(OC5OC(CO)C(O)C(O)C5O)C4O)C3O)C(C(O)CO)O2)C1OP(=O)([O-])O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:gicolipa
biggM:gicolipa
Glucosyl-inner core oligosaccharide lipid A
biggM:M_gicolipa secondary/obsolete/fantasy identifier