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Ganglioside NeuGc-LacNAc-GM1(NeuGc) (d18:1(4E)/16:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1102407Image of MNXM1102407
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC96H165N5O51
charge-2
mass2204.04824
referenceslm:000771810
InChIKeyMGZJBRHUUQKNCX-BDHOKQEKSA-L
InChIInChI=1S/C96H167N5O51/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-49(114)48(99-60(119)32-30-28-26-24-22-20-18-16-14-12-10-8-6-2)45-137-89-74(129)73(128)79(58(41-108)142-89)145-92-77(132)86(152-96(94(135)136)34-51(116)64(101-62(121)44-111)83(150-96)68(123)53(118)36-103)80(59(42-109)143-92)146-88-66(98-47(4)113)81(69(124)54(37-104)138-88)147-90-75(130)84(70(125)55(38-105)139-90)148-87-65(97-46(3)112)72(127)78(57(40-107)141-87)144-91-76(131)85(71(126)56(39-106)140-91)151-95(93(133)134)33-50(115)63(100-61(120)43-110)82(149-95)67(122)52(117)35-102/h29,31,48-59,63-92,102-111,114-118,122-132H,5-28,30,32-45H2,1-4H3,(H,97,112)(H,98,113)(H,99,119)(H,100,120)(H,101,121)(H,133,134)(H,135,136)/p-2/b31-29+/t48-,49+,50-,51-,52+,53+,54+,55+,56+,57+,58+,59+,63+,64+,65+,66+,67+,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-,95-,96-/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@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@]7(C(=O)[O-])C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O7)[C@H]6O)[C@H](O)[C@H]5NC(C)=O)[C@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
SLM:000771810
slm:000771810
Ganglioside NeuGc-LacNAc-GM1(NeuGc) (d18:1(4E)/16:0)
NeuGc-LacNAc-GM1(NeuGc) (d18:1(4E)/16:0)
alpha-N-glycoloylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-glycoloylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-hexadecanoyl-sphing-4E-enine
lipidmaps:LMSP0601BQ01
lipidmapsM:LMSP0601BQ01
NeuGcalpha2-3Galbeta1-4GlcNAcbeta1-3Galbeta1-3GalNAcbeta1-4(NeuGcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0)
Hex(4)-HexNAc(2)-NeuGc(2)-Cer 34:1
O2