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Ganglioside GD2 (d18:1(4E)/6:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM522991Image of MNXM522991
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC66H112N4O34
charge-2
mass1504.71689
referenceslm:000487722
InChIKeyRWVLGTJRMLXBJV-ZHYOZHPOSA-L
InChIInChI=1S/C66H114N4O34/c1-6-8-10-11-12-13-14-15-16-17-18-19-21-22-36(79)35(70-44(83)23-20-9-7-2)31-95-61-53(89)52(88)55(42(29-74)97-61)99-62-54(90)59(56(43(30-75)98-62)100-60-47(69-34(5)78)51(87)49(85)40(27-72)96-60)104-66(64(93)94)25-38(81)46(68-33(4)77)58(103-66)50(86)41(28-73)101-65(63(91)92)24-37(80)45(67-32(3)76)57(102-65)48(84)39(82)26-71/h21-22,35-43,45-62,71-75,79-82,84-90H,6-20,23-31H2,1-5H3,(H,67,76)(H,68,77)(H,69,78)(H,70,83)(H,91,92)(H,93,94)/p-2/b22-21+/t35-,36+,37-,38-,39+,40+,41+,42+,43+,45+,46+,47+,48+,49-,50+,51+,52+,53+,54+,55+,56-,57+,58+,59+,60-,61+,62-,65+,66-/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]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)CCCCC
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Similar chemical compounds in external resources
IdentifierDescription
SLM:000487722
slm:000487722
Ganglioside GD2 (d18:1(4E)/6:0)
GD2(d18:1(4E)/6:0)
N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-galactosyl-(1->4)-beta-glucosyl-(1<->1')-N-(hexanoyl)-sphing-4-enine