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Ganglioside GQ1b alpha (d18:1(4E)/28:6(10Z,13Z,16Z,19Z,22Z,25Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM524812Image of MNXM524812
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC116H186N6O55
charge-4
mass2543.1964
referenceslm:000486015
InChIKeyMRIMXNKLMXPJQY-ZPZVGVTKSA-J
InChIInChI=1S/C116H190N6O55/c1-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-80(143)122-66(67(135)46-44-42-40-38-36-34-21-19-17-15-13-11-9-2)59-162-106-93(151)92(150)96(77(57-128)165-106)168-108-95(153)104(177-116(112(160)161)51-71(139)84(120-64(6)133)102(175-116)90(148)76(56-127)171-114(110(156)157)49-69(137)82(118-62(4)131)100(173-114)87(145)73(141)53-124)97(78(58-129)166-108)169-105-85(121-65(7)134)98(91(149)79(167-105)60-163-113(109(154)155)48-68(136)81(117-61(3)130)99(172-113)86(144)72(140)52-123)170-107-94(152)103(89(147)75(55-126)164-107)176-115(111(158)159)50-70(138)83(119-63(5)132)101(174-115)88(146)74(142)54-125/h10,12,16,18,22-23,25-26,28-29,31-32,44,46,66-79,81-108,123-129,135-142,144-153H,8-9,11,13-15,17,19-21,24,27,30,33-43,45,47-60H2,1-7H3,(H,117,130)(H,118,131)(H,119,132)(H,120,133)(H,121,134)(H,122,143)(H,154,155)(H,156,157)(H,158,159)(H,160,161)/p-4/b12-10-,18-16-,23-22-,26-25-,29-28-,32-31-,46-44+/t66-,67+,68-,69-,70-,71-,72+,73+,74+,75+,76+,77+,78+,79+,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-,113+,114+,115-,116-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@@H](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
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Similar chemical compounds in external resources
IdentifierDescription
SLM:000486015
slm:000486015
Ganglioside GQ1b alpha (d18:1(4E)/28:6(10Z,13Z,16Z,19Z,22Z,25Z))
GQ1b alpha(d18:1(4E)/28:6(10Z,13Z,16Z,19Z,22Z,25Z))
alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-[alpha-N-acetylneuraminosyl-(2->6)]-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-(10Z,13Z,16Z,19Z,22Z,25Z-octacosahexaenoyl)-sphing-4-enine