Feedback

KDN)GD1a(d18:1/24:1(15Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM25501Image of MNXM25501
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC88H155N3O39
charge0
mass1878.02377
referencelipidmapsM:LMSP0601CC07
InChIKeyRJYZBBRKCBOGIK-YGWHUCTHSA-N
InChIInChI=1S/C88H155N3O39/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-62(105)91-52(53(100)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)49-119-82-71(112)70(111)74(60(47-96)122-82)124-84-73(114)80(130-88(86(117)118)42-55(102)65(106)78(128-88)67(108)57(104)44-93)75(61(48-97)123-84)125-81-64(90-51(4)99)76(68(109)58(45-94)120-81)126-83-72(113)79(69(110)59(46-95)121-83)129-87(85(115)116)41-54(101)63(89-50(3)98)77(127-87)66(107)56(103)43-92/h19-20,37,39,52-61,63-84,92-97,100-104,106-114H,5-18,21-36,38,40-49H2,1-4H3,(H,89,98)(H,90,99)(H,91,105)(H,115,116)(H,117,118)/b20-19-,39-37+/t52-,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-,87-,88-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)N[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@]5(C(=O)O)CC(O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O5)C4O)C3NC(C)=O)[C@H](O[C@]3(C(=O)O)CC(O)[C@@H](O)C([C@H](O)[C@H](O)CO)O3)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:LMSP0601CC07
lipidmapsM:LMSP0601CC07
KDN)GD1a(d18:1/24:1(15Z))
Hex(3)-HexNAc-NeuAc-KDN-Cer 42:2
NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(KDNalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))
O2