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Ganglioside GalGal-GD1b (d18:1(4E)/16:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1103106Image of MNXM1103106
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC94H162N4O49
charge-2
mass2131.03186
referenceslm:000767050
InChIKeyCOZGVWHCMVFJNA-IAHWKTMYSA-L
InChIInChI=1S/C94H164N4O49/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-49(110)48(98-60(114)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)44-132-86-73(124)71(122)77(58(42-105)137-86)139-90-76(127)84(147-94(92(130)131)35-51(112)62(96-46(4)108)81(146-94)69(120)57(41-104)144-93(91(128)129)34-50(111)61(95-45(3)107)80(145-93)64(115)52(113)36-99)78(59(43-106)138-90)140-85-63(97-47(5)109)79(66(117)54(38-101)133-85)141-88-74(125)83(68(119)55(39-102)135-88)143-89-75(126)82(67(118)56(40-103)136-89)142-87-72(123)70(121)65(116)53(37-100)134-87/h30,32,48-59,61-90,99-106,110-113,115-127H,6-29,31,33-44H2,1-5H3,(H,95,107)(H,96,108)(H,97,109)(H,98,114)(H,128,129)(H,130,131)/p-2/b32-30+/t48-,49+,50-,51-,52+,53+,54+,55+,56+,57+,58+,59+,61+,62+,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-,93+,94-/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](O[C@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H]5O)[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)CCCCCCCCCCCCCCC
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Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
SLM:000767050
slm:000767050
Ganglioside GalGal-GD1b (d18:1(4E)/16:0)
GalGal-GD1b (d18:1(4E)/16:0)
alpha-D-galactosyl-(1->3)-alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->3)-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-hexadecanoyl-sphing-4E-enine
lipidmaps:LMSP0601CL01
lipidmapsM:LMSP0601CL01
Galalpha1-3Galalpha1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/16:0)
Hex(5)-HexNAc-NeuAc(2)-Cer 34:1
O2