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Ganglioside GD1a (d18:1(4E)/19:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM522596Image of MNXM522596
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC85H148N4O39
charge-2
mass1848.97317
referenceslm:000486311
InChIKeySCUDKFUIRQWEBR-MSVOGVJXSA-L
InChIInChI=1S/C85H150N4O39/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-59(104)89-49(50(99)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2)45-117-79-68(110)67(109)71(57(43-94)120-79)122-81-70(112)77(128-85(83(115)116)38-52(101)61(87-47(4)97)75(126-85)64(106)54(103)40-91)72(58(44-95)121-81)123-78-62(88-48(5)98)73(65(107)55(41-92)118-78)124-80-69(111)76(66(108)56(42-93)119-80)127-84(82(113)114)37-51(100)60(86-46(3)96)74(125-84)63(105)53(102)39-90/h33,35,49-58,60-81,90-95,99-103,105-112H,6-32,34,36-45H2,1-5H3,(H,86,96)(H,87,97)(H,88,98)(H,89,104)(H,113,114)(H,115,116)/p-2/b35-33+/t49-,50+,51-,52-,53+,54+,55+,56+,57+,58+,60+,61+,62+,63+,64+,65-,66-,67+,68+,69+,70+,71+,72-,73+,74+,75+,76-,77+,78-,79+,80-,81-,84-,85-/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@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](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCC
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IdentifierDescription
SLM:000486311
slm:000486311
Ganglioside GD1a (d18:1(4E)/19:0)
GD1a(d18:1(4E)/19:0)
alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-(nonadecanoyl)-sphing-4-enine