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Ganglioside GM4 (d18:1(4E)/13:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM524029Image of MNXM524029
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC48H87N2O16
charge-1
mass947.60611
referenceslm:000485896
InChIKeyDRBVOBGYEBEUDF-OMKZXOEESA-M
InChIInChI=1S/C48H88N2O16/c1-4-6-8-10-12-14-16-17-18-19-21-23-25-27-35(54)34(50-39(57)28-26-24-22-20-15-13-11-9-7-5-2)32-63-46-43(60)45(42(59)38(31-52)64-46)66-48(47(61)62)29-36(55)40(49-33(3)53)44(65-48)41(58)37(56)30-51/h25,27,34-38,40-46,51-52,54-56,58-60H,4-24,26,28-32H2,1-3H3,(H,49,53)(H,50,57)(H,61,62)/p-1/b27-25+/t34-,35+,36-,37+,38+,40+,41+,42-,43+,44+,45-,46+,48-/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@]2(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O2)[C@H]1O)NC(=O)CCCCCCCCCCCC
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Similar chemical compounds in external resources
IdentifierDescription
SLM:000485896
slm:000485896
Ganglioside GM4 (d18:1(4E)/13:0)
GM4(d18:1(4E)/13:0)
alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1<->1')-N-(tridecanoyl)-sphing-4-enine