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Galbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/22:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM26498Image of MNXM26498
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC69H126N2O26
charge0
mass1398.85988
referencelipidmapsM:LMSP0601DC04
InChIKeyMYQQYGFKONUBOA-FHOPUMJHSA-N
InChIInChI=1S/C69H126N2O26/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-37-52(80)71-45(46(77)36-34-32-30-28-26-24-17-15-13-11-9-7-5-2)43-90-65-59(86)57(84)61(50(41-74)92-65)94-67-60(87)64(62(51(42-75)93-67)95-66-58(85)56(83)55(82)49(40-73)91-66)97-69(68(88)89)38-47(78)53(70-44(3)76)63(96-69)54(81)48(79)39-72/h34,36,45-51,53-67,72-75,77-79,81-87H,4-33,35,37-43H2,1-3H3,(H,70,76)(H,71,80)(H,88,89)/b36-34+/t45-,46+,47?,48+,49?,50?,51?,53+,54+,55-,56-,57+,58?,59?,60?,61+,62-,63?,64+,65+,66-,67-,69-/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)C3O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0601DC04
lipidmapsM:LMSP0601DC04
Galbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/22:0)
Hex(3)-NeuAc-Cer 40:1
O2