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Ganglioside GQ1b alpha (d18:1(4E)/26:1(17Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM1102834Image of MNXM1102834
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC114H192N6O55
charge-4
mass2525.24335
referenceslm:000486050
InChIKeyJPKVHNKCPDPDFQ-CCVZCSGXSA-J
InChIInChI=1S/C114H196N6O55/c1-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-33-35-37-39-41-43-45-78(141)120-64(65(133)44-42-40-38-36-34-32-21-19-17-15-13-11-9-2)57-160-104-91(149)90(148)94(75(55-126)163-104)166-106-93(151)102(175-114(110(158)159)49-69(137)82(118-62(6)131)100(173-114)88(146)74(54-125)169-112(108(154)155)47-67(135)80(116-60(4)129)98(171-112)85(143)71(139)51-122)95(76(56-127)164-106)167-103-83(119-63(7)132)96(89(147)77(165-103)58-161-111(107(152)153)46-66(134)79(115-59(3)128)97(170-111)84(142)70(138)50-121)168-105-92(150)101(87(145)73(53-124)162-105)174-113(109(156)157)48-68(136)81(117-61(5)130)99(172-113)86(144)72(140)52-123/h22-23,42,44,64-77,79-106,121-127,133-140,142-151H,8-21,24-41,43,45-58H2,1-7H3,(H,115,128)(H,116,129)(H,117,130)(H,118,131)(H,119,132)(H,120,141)(H,152,153)(H,154,155)(H,156,157)(H,158,159)/p-4/b23-22-,44-42+/t64-,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-,111+,112+,113-,114-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=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:000486050
slm:000486050
Ganglioside GQ1b alpha (d18:1(4E)/26:1(17Z))
GQ1b alpha(d18:1(4E)/26:1(17Z))
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-(17Z-hexacosenoyl)-sphing-4-enine
lipidmaps:LMSP0601BJ08
lipidmapsM:LMSP0601BJ08
GQ1ba(d18:1/26:1(17Z))
Hex(3)-HexNAc-NeuAc(4)-Cer 44:2
NeuAcalpha2-3Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))
O2