Feedback

IV 3-nLcOse4(d18:1/24:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM27681Image of MNXM27681
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC82H149N3O33
charge0
mass1704.00733
referencelipidmapsM:LMSP0505EL05
InChIKeyINWBBQWGMAXTSW-QAPGXSBYSA-N
InChIInChI=1S/C82H149N3O33/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-58(95)85-50(51(94)39-37-35-33-31-29-27-18-16-14-12-10-8-6-2)47-107-79-68(103)67(102)73(57(46-91)113-79)115-81-69(104)74(62(97)53(42-87)110-81)117-78-60(84-49(4)93)66(101)72(56(45-90)112-78)114-80-71(106)76(64(99)55(44-89)109-80)118-82-70(105)75(63(98)54(43-88)111-82)116-77-59(83-48(3)92)65(100)61(96)52(41-86)108-77/h37,39,50-57,59-82,86-91,94,96-106H,5-36,38,40-47H2,1-4H3,(H,83,92)(H,84,93)(H,85,95)/b39-37+/t50-,51+,52?,53?,54?,55?,56?,57?,59?,60?,61-,62-,63-,64-,65+,66+,67+,68?,69?,70?,71?,72+,73+,74-,75-,76-,77-,78-,79+,80-,81-,82+/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[C@@H]6OC(CO)[C@H](O)[C@H](O)C6NC(C)=O)C5O)C4O)[C@H](O)C3NC(C)=O)C2O)[C@H](O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0505EL05
lipidmapsM:LMSP0505EL05
IV 3-nLcOse4(d18:1/24:0)
GalNAcbeta1-3Galalpha1-3Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:0)
Hex(4)-HexNAc(2)-Cer 42:1
O2