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Aleb(d18:1/24:1(15Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM26880Image of MNXM26880
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC88H157N3O36
charge0
mass1832.05468
referencelipidmapsM:LMSP0504AH07
InChIKeyUWOOCWMFTYVOIH-IHPRUEFMSA-N
InChIInChI=1S/C88H157N3O36/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-60(100)91-53(54(99)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)48-114-84-74(112)71(109)76(58(46-95)121-84)122-87-75(113)79(66(104)56(44-93)118-87)125-83-62(90-52(6)98)78(77(59(47-96)120-83)123-85-72(110)69(107)63(101)49(3)115-85)124-88-81(127-86-73(111)70(108)64(102)50(4)116-86)80(67(105)57(45-94)119-88)126-82-61(89-51(5)97)68(106)65(103)55(43-92)117-82/h21-22,39,41,49-50,53-59,61-88,92-96,99,101-113H,7-20,23-38,40,42-48H2,1-6H3,(H,89,97)(H,90,98)(H,91,100)/b22-21-,41-39+/t49?,50?,53-,54+,55?,56?,57?,58?,59?,61?,62?,63+,64+,65-,66-,67-,68+,69?,70?,71+,72-,73-,74?,75?,76+,77+,78+,79-,80-,81?,82+,83-,84+,85+,86+,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](O[C@@H]3OC(CO)[C@@H](O[C@H]4OC(C)[C@@H](O)C(O)[C@@H]4O)[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]4OC(C)[C@@H](O)C(O)[C@@H]4O)C3NC(C)=O)C2O)[C@H](O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC
Parent-child relations graph
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Similar chemical compounds in external resources
IdentifierDescription
lipidmaps:LMSP0504AH07
lipidmapsM:LMSP0504AH07
Aleb(d18:1/24:1(15Z))
GalNAcalpha1-3(Fucalpha1-2)Galbeta1-3(Fucalpha1-4)GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))
Hex(3)-HexNAc(2)-Fuc(2)-Cer 42:2
O2