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(enterobacterial common antigen)x3 undecaprenyl-diphosphate

MNXM6543 is deprecated and here replaced by MNXM1137718
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1137718Image of MNXM1137718
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
formulaC127H198N9O52P2
charge-5
mass2743.26285
referencebiggM:eca3und
InChIKeyGPIOMJJQJHAZOP-UHFFFAOYSA-I
InChIInChI=1S/C127H203N9O52P2/c1-60(2)35-25-36-61(3)37-26-38-62(4)39-27-40-63(5)41-28-42-64(6)43-29-44-65(7)45-30-46-66(8)47-31-48-67(9)49-32-50-68(10)51-33-52-69(11)53-34-54-70(12)55-56-169-189(165,166)188-190(167,168)187-124-94(136-82(24)148)98(152)107(85(59-139)175-124)178-123-93(135-81(23)147)101(155)112(115(186-123)118(163)164)183-127-104(158)109(88(73(15)172-127)130-76(18)142)180-120-90(132-78(20)144)97(151)106(84(58-138)174-120)177-122-92(134-80(22)146)100(154)111(114(185-122)117(161)162)182-126-103(157)108(87(72(14)171-126)129-75(17)141)179-119-89(131-77(19)143)96(150)105(83(57-137)173-119)176-121-91(133-79(21)145)99(153)110(113(184-121)116(159)160)181-125-102(156)95(149)86(71(13)170-125)128-74(16)140/h35,37,39,41,43,45,47,49,51,53,55,71-73,83-115,119-127,137-139,149-158H,25-34,36,38,40,42,44,46,48,50,52,54,56-59H2,1-24H3,(H,128,140)(H,129,141)(H,130,142)(H,131,143)(H,132,144)(H,133,145)(H,134,146)(H,135,147)(H,136,148)(H,159,160)(H,161,162)(H,163,164)(H,165,166)(H,167,168)/p-5
SMILESCC(=O)NC1C(C)OC(OC2C(C(=O)[O-])OC(OC3C(CO)OC(OC4C(O)C(OC5C(C(=O)[O-])OC(OC6C(CO)OC(OC7C(O)C(OC8C(C(=O)[O-])OC(OC9C(CO)OC(OP(=O)([O-])OP(=O)([O-])OCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C(NC(C)=O)C9O)C(NC(C)=O)C8O)OC(C)C7NC(C)=O)C(NC(C)=O)C6O)C(NC(C)=O)C5O)OC(C)C4NC(C)=O)C(NC(C)=O)C3O)C(NC(C)=O)C2O)C(O)C1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:eca3und
biggM:eca3und 		(enterobacterial common antigen)x3 undecaprenyl-diphosphate
biggM:M_eca3und secondary/obsolete/fantasy identifier