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B-IV antigen(d18:1/24:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM29502Image of MNXM29502
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC134H235N5O71
charge0
mass3050.49319
referencelipidmapsM:LMSP0505EP05
InChIKeyGIKKROVPLNHWCH-FBLNYYHJSA-N
InChIInChI=1S/C134H235N5O71/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-78(156)139-64(65(155)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2)56-183-125-105(179)100(174)113(76(55-150)197-125)201-131-107(181)115(88(162)69(48-143)190-131)205-122-80(136-61(6)152)94(168)110(74(53-148)194-122)200-132-108(182)116(91(165)77(198-132)57-184-121-79(135-60(5)151)92(166)111(72(51-146)193-121)202-133-119(209-126-101(175)96(170)83(157)58(3)185-126)117(89(163)70(49-144)191-133)207-128-103(177)98(172)85(159)66(45-140)187-128)206-124-81(137-62(7)153)93(167)109(73(52-147)195-124)199-130-106(180)114(87(161)68(47-142)189-130)204-123-82(138-63(8)154)95(169)112(75(54-149)196-123)203-134-120(210-127-102(176)97(171)84(158)59(4)186-127)118(90(164)71(50-145)192-134)208-129-104(178)99(173)86(160)67(46-141)188-129/h41,43,58-59,64-77,79-134,140-150,155,157-182H,9-40,42,44-57H2,1-8H3,(H,135,151)(H,136,152)(H,137,153)(H,138,154)(H,139,156)/b43-41+/t58?,59?,64-,65+,66?,67?,68?,69?,70?,71?,72?,73?,74?,75?,76?,77?,79?,80?,81?,82?,83+,84+,85-,86-,87-,88-,89-,90-,91-,92+,93+,94+,95+,96?,97?,98-,99-,100+,101-,102-,103?,104?,105?,106?,107?,108?,109+,110+,111+,112+,113+,114-,115-,116-,117-,118-,119?,120?,121+,122-,123-,124-,125+,126+,127+,128-,129-,130-,131-,132-,133-,134-/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@H](O)[C@H](O)C7O)C6O[C@H]6OC(C)[C@@H](O)C(O)[C@@H]6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@@H]7OC(CO)[C@@H](O[C@@H]8OC(CO)[C@H](O)[C@H](O[C@@H]9OC(CO)[C@H](O)[C@H](O)C9O)C8O[C@H]8OC(C)[C@@H](O)C(O)[C@@H]8O)[C@H](O)C7NC(C)=O)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0505EP05
lipidmapsM:LMSP0505EP05
B-IV antigen(d18:1/24:0)
Fucalpha1-2(Galalpha1-3)Galbeta1-4GlcNAcbeta1-6(Galalpha1-3(Fucalpha1-2)Galbeta1-4GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)
Hex(8)-HexNAc(4)-Fuc(2)-Cer 42:1
O2