Feedback

NeuAcalpha2-3Galbeta1-4GlcNAcalpha1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM1107101Image of MNXM1107101
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC109H191N5O51
charge0
mass2386.2506
referencelipidmapsM:LMSP0601GC08
InChIKeyHIGJOQAXXKLBTJ-NGKRHYGESA-N
InChIInChI=1S/C109H191N5O51/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-72(130)114-60(61(127)43-41-39-37-35-33-31-20-18-16-14-12-10-8-2)54-148-103-88(142)86(140)95(70(53-122)156-103)161-105-89(143)97(79(133)65(48-117)151-105)162-101-75(112-58(5)125)83(137)93(68(51-120)154-101)159-106-90(144)98(81(135)71(157-106)55-149-100-74(111-57(4)124)82(136)92(67(50-119)153-100)158-104-87(141)85(139)78(132)64(47-116)150-104)163-102-76(113-59(6)126)84(138)94(69(52-121)155-102)160-107-91(145)99(80(134)66(49-118)152-107)165-109(108(146)147)45-62(128)73(110-56(3)123)96(164-109)77(131)63(129)46-115/h21-22,41,43,60-71,73-107,115-122,127-129,131-145H,7-20,23-40,42,44-55H2,1-6H3,(H,110,123)(H,111,124)(H,112,125)(H,113,126)(H,114,130)(H,146,147)/b22-21-,43-41+/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-,98-,99-,100+,101-,102+,103+,104-,105-,106-,107-,109-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO[C@@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O)C6O)[C@H](O)C5NC(C)=O)[C@H](O)[C@H](O[C@H]5OC(CO)[C@@H](O[C@@H]6OC(CO)[C@H](O)[C@H](O[C@]7(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O7)C6O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0601GC08
lipidmapsM:LMSP0601GC08
NeuAcalpha2-3Galbeta1-4GlcNAcalpha1-3(Galbeta1-4GlcNAcbeta1-6)Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/26:1(17Z))
Hex(5)-HexNAc(3)-NeuAc-Cer 44:2
O2