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CHEBI:73110 - ganglioside GM1(1−)

ChEBI IDCHEBI:73110
ChEBI Nameganglioside GM1(1−)
Stars
ASCII Nameganglioside GM1(1-)
DefinitionA carbohydrate acid derivative anion obtained by deprotonation of the carboxy group of GM1 ganglioside.
Last Modified12 February 2024
Submitterabridge
DownloadsMolfile
FormulaC73H130N3O31
Net Charge-1
Average Mass1545.833
Monoisotopic Mass1544.86938
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@@H]2[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](OC[C@H](NC(=O)CCCCCCCCCCCCCCCCC)[C@H](O)/C=C/CCCCCCCCCCCCC)O[C@@H]3CO)O[C@H](CO)[C@@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2NC(C)=O)(C(=O)[O-])C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C73H131N3O31/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-52(87)76-44(45(84)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2)41-98-69-61(94)59(92)63(50(39-80)101-69)103-71-62(95)67(107-73(72(96)97)35-46(85)53(74-42(3)82)66(106-73)55(88)47(86)36-77)64(51(40-81)102-71)104-68-54(75-43(4)83)65(57(90)49(38-79)99-68)105-70-60(93)58(91)56(89)48(37-78)100-70/h31,33,44-51,53-71,77-81,84-86,88-95H,5-30,32,34-41H2,1-4H3,(H,74,82)(H,75,83)(H,76,87)(H,96,97)/p-1/b33-31+/t44-,45+,46-,47+,48+,49+,50+,51+,53+,54+,55+,56-,57-,58-,59+,60+,61+,62+,63+,64-,65+,66+,67+,68-,69+,70-,71-,73-/m0/s1
InChIKeyQPJBWNIQKHGLAU-IQZHVAEDSA-M
ChEBI Ontology
Outgoing Relation(s)
ganglioside GM1(1−) (CHEBI:73110) is a ganglioside GM1/1b(1−) (CHEBI:88056)
ganglioside GM1(1−) (CHEBI:73110) is a α-N-acetylneuraminosyl-(2→3)-[β-D-galactosyl-(1→3)-N-acetyl-β-D-galactosaminyl-(1→4)]-β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-ceramide(1−) (CHEBI:82639)
ganglioside GM1(1−) (CHEBI:73110) is conjugate base of ganglioside GM1 (CHEBI:61048)
Incoming Relation(s)
ganglioside GM1 (CHEBI:61048) is conjugate acid of ganglioside GM1(1−) (CHEBI:73110)
Synonyms  Source
GM1SUBMITTER
monosialoganglioside GM1SUBMITTER
α-Neu5Ac-(2→3)-[β-D-Gal-(1→3)-β-D-GalNAc-(1→4)]-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-N-stearoylsphingosine(1−)ChEBI
GM1 ganglioside(1−)ChEBI
UniProt Name  Source
ganglioside GM1 (d18:1(4E)/18:0)UniProt