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Ganglioside Ac-O-9-GT1b (d18:1(4E)/24:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1102947Image of MNXM1102947
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC103H176N5O48
charge-3
mass2251.15012
referenceslm:000779295
InChIKeyYSAYIBOTYMARFW-IMONFHMCSA-K
InChIInChI=1S/C103H179N5O48/c1-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-72(126)108-60(61(120)42-40-38-36-34-32-30-21-19-17-15-13-11-9-2)53-143-95-83(133)82(132)86(70(51-113)146-95)148-97-85(135)93(156-103(100(140)141)46-64(123)75(106-57(5)117)91(154-103)81(131)69(50-112)151-101(98(136)137)44-62(121)74(105-56(4)116)90(152-101)78(128)66(125)54-142-59(7)119)87(71(52-114)147-97)149-94-76(107-58(6)118)88(79(129)67(48-110)144-94)150-96-84(134)92(80(130)68(49-111)145-96)155-102(99(138)139)45-63(122)73(104-55(3)115)89(153-102)77(127)65(124)47-109/h40,42,60-71,73-97,109-114,120-125,127-135H,8-39,41,43-54H2,1-7H3,(H,104,115)(H,105,116)(H,106,117)(H,107,118)(H,108,126)(H,136,137)(H,138,139)(H,140,141)/p-3/b42-40+/t60-,61+,62-,63-,64-,65+,66+,67+,68+,69+,70+,71+,73+,74+,75+,76+,77+,78+,79-,80-,81+,82+,83+,84+,85+,86+,87-,88+,89+,90+,91+,92-,93+,94-,95+,96-,97-,101+,102-,103-/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](CO)O[C@]4(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)COC(C)=O)O4)O3)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
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Similar chemical compounds in external resources
IdentifierDescription
SLM:000779295
slm:000779295
Ganglioside Ac-O-9-GT1b (d18:1(4E)/24:0)
Ac-O-9-GT1b (d18:1(4E)/24:0)
alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetyl-9-O-acetylneuraminosyl-(2->8)-alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-tetracosanoyl-sphing-4E-enine
lipidmaps:LMSP0601BL05
lipidmapsM:LMSP0601BL05
9-0-acetyl GTb1(d18:1/24:0)
NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(9-OAc-NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0)