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nLc5Cer(d18:1/16:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1102646Image of MNXM1102646
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC68H123N3O28
charge0
mass1429.82931
referencelipidmapsM:LMSP0505AK01
InChIKeyVFPAMRWNZCZNLF-TVMWBXOTSA-N
InChIInChI=1S/C68H123N3O28/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-42(79)41(71-48(80)32-30-28-26-24-22-20-18-16-14-12-10-8-6-2)38-90-66-57(87)56(86)61(47(37-76)95-66)97-68-59(89)63(53(83)45(35-74)93-68)99-65-50(70-40(4)78)55(85)60(46(36-75)94-65)96-67-58(88)62(52(82)44(34-73)92-67)98-64-49(69-39(3)77)54(84)51(81)43(33-72)91-64/h29,31,41-47,49-68,72-76,79,81-89H,5-28,30,32-38H2,1-4H3,(H,69,77)(H,70,78)(H,71,80)/b31-29+/t41-,42+,43?,44?,45?,46?,47?,49?,50?,51+,52-,53-,54+,55+,56+,57?,58?,59?,60+,61+,62-,63-,64-,65-,66+,67-,68-/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](O[C@@H]3OC(CO)[C@@H](O[C@@H]4OC(CO)[C@H](O)[C@H](O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5NC(C)=O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0505AK01
lipidmapsM:LMSP0505AK01
nLc5Cer(d18:1/16:0)
GlcNAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/16:0)
Hex(3)-HexNAc(2)-Cer 34:1
O2