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NeuAcalpha2-3Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/20:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1102923Image of MNXM1102923
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC92H162N4O44
charge0
mass2027.05619
referencelipidmapsM:LMSP0601AC03
InChIKeyHTXUXCWYPUZKIY-OEKPLELSSA-N
InChIInChI=1S/C92H162N4O44/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-62(111)96-51(52(106)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2)46-127-85-73(119)71(117)77(59(44-101)131-85)134-86-74(120)72(118)78(60(45-102)132-86)135-87-75(121)82(68(114)57(42-99)129-87)137-84-65(95-50(5)105)79(70(116)61(133-84)47-128-91(89(123)124)38-53(107)63(93-48(3)103)80(138-91)66(112)55(109)40-97)136-88-76(122)83(69(115)58(43-100)130-88)140-92(90(125)126)39-54(108)64(94-49(4)104)81(139-92)67(113)56(110)41-98/h34,36,51-61,63-88,97-102,106-110,112-122H,6-33,35,37-47H2,1-5H3,(H,93,103)(H,94,104)(H,95,105)(H,96,111)(H,123,124)(H,125,126)/b36-34+/t51-,52+,53?,54?,55+,56+,57?,58?,59?,60?,61?,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-,91+,92-/m0/s1
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O[C@@H]3OC(CO)[C@H](O)[C@H](O[C@@H]4OC(CO[C@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O[C@]6(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O6)C5O)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC
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Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0601AC03
lipidmapsM:LMSP0601AC03
NeuAcalpha2-3Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/20:0)
Hex(4)-HexNAc-NeuAc(2)-Cer 38:1
O2