Feedback

Ganglioside Ac-O-9-GD1a (d18:1(4E)/24:1(15Z))

PropertiesImageOccurences in reactions
MNX_IDMNXM1102460Image of MNXM1102460
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC92H158N4O40
charge-2
mass1959.04633
referenceslm:000762180
InChIKeySUGCFWVJMHVWNH-RFGQWGAQSA-L
InChIInChI=1S/C92H160N4O40/c1-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-66(111)96-56(57(106)41-39-37-35-33-31-29-20-18-16-14-12-10-8-2)50-125-86-75(117)74(116)78(64(48-100)128-86)130-88-77(119)84(136-92(90(122)123)44-59(108)67(93-52(3)102)81(133-92)70(112)60(109)45-97)79(65(49-101)129-88)131-85-69(95-54(5)104)80(72(114)62(46-98)126-85)132-87-76(118)83(73(115)63(47-99)127-87)135-91(89(120)121)43-58(107)68(94-53(4)103)82(134-91)71(113)61(110)51-124-55(6)105/h21-22,39,41,56-65,67-88,97-101,106-110,112-119H,7-20,23-38,40,42-51H2,1-6H3,(H,93,102)(H,94,103)(H,95,104)(H,96,111)(H,120,121)(H,122,123)/p-2/b22-21-,41-39+/t56-,57+,58-,59-,60+,61+,62+,63+,64+,65+,67+,68+,69+,70+,71+,72-,73-,74+,75+,76+,77+,78+,79-,80+,81+,82+,83-,84+,85-,86+,87-,88-,91-,92-/m0/s1
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)COC(C)=O)O5)[C@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
SLM:000762180
slm:000762180
Ganglioside Ac-O-9-GD1a (d18:1(4E)/24:1(15Z))
Ac-O-9-GD1a (d18:1(4E)/24:1(15Z))
alpha-N-acetyl-9-O-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminosyl-(2->3)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-(15Z-tetracosenoyl)-sphing-4E-enine
lipidmaps:LMSP0601CK07
lipidmapsM:LMSP0601CK07
9-OAc-NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z))