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Ganglioside GQ1b alpha (d18:1(4E)/iso15:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM524839Image of MNXM524839
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC103H172N6O55
charge-4
mass2373.08685
referenceslm:000486054
InChIKeyRQMMZJOEHGCNDW-KRVBOHOESA-J
InChIInChI=1S/C103H176N6O55/c1-9-10-11-12-13-14-15-16-17-20-23-26-29-32-54(122)53(109-67(130)33-30-27-24-21-18-19-22-25-28-31-47(2)3)45-149-93-80(138)79(137)83(64(43-115)152-93)155-95-82(140)91(164-103(99(147)148)37-58(126)71(107-51(7)120)89(162-103)77(135)63(42-114)158-101(97(143)144)35-56(124)69(105-49(5)118)87(160-101)74(132)60(128)39-111)84(65(44-116)153-95)156-92-72(108-52(8)121)85(78(136)66(154-92)46-150-100(96(141)142)34-55(123)68(104-48(4)117)86(159-100)73(131)59(127)38-110)157-94-81(139)90(76(134)62(41-113)151-94)163-102(98(145)146)36-57(125)70(106-50(6)119)88(161-102)75(133)61(129)40-112/h29,32,47,53-66,68-95,110-116,122-129,131-140H,9-28,30-31,33-46H2,1-8H3,(H,104,117)(H,105,118)(H,106,119)(H,107,120)(H,108,121)(H,109,130)(H,141,142)(H,143,144)(H,145,146)(H,147,148)/p-4/b32-29+/t53-,54+,55-,56-,57-,58-,59+,60+,61+,62+,63+,64+,65+,66+,68+,69+,70+,71+,72+,73+,74+,75+,76-,77+,78-,79+,80+,81+,82+,83+,84-,85+,86+,87+,88+,89+,90-,91+,92-,93+,94-,95-,100+,101+,102-,103-/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[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)NC(=O)CCCCCCCCCCCC(C)C
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IdentifierDescription
SLM:000486054
slm:000486054
Ganglioside GQ1b alpha (d18:1(4E)/iso15:0)
GQ1b alpha(d18:1(4E)/iso15:0)
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-(13-methyltetradecanoyl)-sphing-4-enine