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NeuGcalpha2-3Galbeta1-3GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/26:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1103140Image of MNXM1103140
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC87H157N3O37
charge0
mass1836.04959
referencelipidmapsM:LMSP0601AF06
InChIKeyNMURYFQNEJUZRH-XLYARWNNSA-N
InChIInChI=1S/C87H157N3O37/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-61(102)89-52(53(99)40-38-36-34-32-30-28-17-15-13-11-9-7-5-2)50-116-82-71(110)69(108)75(59(47-95)120-82)122-83-72(111)70(109)76(60(48-96)121-83)123-84-73(112)79(67(106)57(45-93)118-84)125-81-64(88-51(3)98)77(66(105)56(44-92)117-81)124-85-74(113)80(68(107)58(46-94)119-85)127-87(86(114)115)42-54(100)63(90-62(103)49-97)78(126-87)65(104)55(101)43-91/h38,40,52-60,63-85,91-97,99-101,104-113H,4-37,39,41-50H2,1-3H3,(H,88,98)(H,89,102)(H,90,103)(H,114,115)/b40-38+/t52-,53+,54?,55+,56?,57?,58?,59?,60?,63+,64?,65+,66-,67-,68-,69+,70+,71?,72?,73?,74?,75+,76-,77+,78?,79-,80-,81-,82+,83-,84-,85-,87-/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@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(=O)CO)C([C@H](O)[C@H](O)CO)O6)C5O)C4NC(C)=O)C3O)[C@H](O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0601AF06
lipidmapsM:LMSP0601AF06
NeuGcalpha2-3Galbeta1-3GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:1/26:0)
Hex(4)-HexNAc-NeuGc-Cer 44:1
O2