EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:139308 - α-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAcO[CH2]6CH=CH2

ChEBI IDCHEBI:139308
ChEBI Nameα-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAcO[CH2]6CH=CH2
Stars
ASCII Namealpha-L-Fucp-(1->2)-[alpha-D-GalpNAc-(1->3)]-beta-D-Galp-(1->3)-alpha-D-GalpNAcO[CH2]6CH=CH2
DefinitionA glycoside formed between the branched tetrasaccharide α-L-Fuc-(1→2)-[α-D-GalNAc-(1→3)]-β-D-Gal-(1→3)-α-D-GalNAc and the alkenyl alcohol oct-7-en-1-ol.
Last Modified18 December 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC36H62N2O20
Net Charge0
Average Mass842.886
Monoisotopic Mass842.38959
SMILESC=CCCCCCCO[C@H]1O[C@H](CO)[C@H](O)[C@H](O[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]3NC(C)=O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1NC(C)=O
InChIInChI=1S/C36H62N2O20/c1-5-6-7-8-9-10-11-51-33-22(38-17(4)43)30(25(46)19(13-40)53-33)56-36-32(58-35-29(50)28(49)23(44)15(2)52-35)31(26(47)20(14-41)55-36)57-34-21(37-16(3)42)27(48)24(45)18(12-39)54-34/h5,15,18-36,39-41,44-50H,1,6-14H2,2-4H3,(H,37,42)(H,38,43)/t15-,18+,19+,20+,21+,22+,23+,24-,25-,26-,27+,28+,29-,30+,31-,32+,33-,34+,35-,36-/m0/s1
InChIKeyPXLAMLNGOCNQSO-AQYHBTMWSA-N
ChEBI Ontology
Outgoing Relation(s)
α-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAcO[CH2]6CH=CH2 (CHEBI:139308) has functional parent oct-7-en-1-ol (CHEBI:139284)
α-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAcO[CH2]6CH=CH2 (CHEBI:139308) has part α-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAc-yl group (CHEBI:88111)
α-L-Fucp-(1→2)-[α-D-GalpNAc-(1→3)]-β-D-Galp-(1→3)-α-D-GalpNAcO[CH2]6CH=CH2 (CHEBI:139308) is a glycoside (CHEBI:24400)
IUPAC Name 
oct-7-en-1-yl 2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-[α-L-fucopyranosyl-(1→2)]-β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galactopyranoside
Synonyms  Source
oct-7-en-1-yl N-acetyl-α-D-galactosaminyl-(1→3)-[α-L-fucosyl-(1→2)]-β-D-galactosyl-(1→3)-N-acetyl-α-D-galactosaminideChEBI
α-L-Fuc-(1→2)-[α-D-GalNAc-(1→3)]-β-D-Gal-(1→3)-α-D-GalNAcO[CH2]6CH=CH2ChEBI
oct-7-en-1-yl 2-acetamido-2-deoxy-α-D-galactopyranosyl-(1→3)-[6-deoxy-α-L-galactopyranosyl-(1→2)]-β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-α-D-galactopyranosideIUPAC
α-D-GalNAc-(1,3)-[α-L-Fuc-(1,2)]-β-D-Gal-(1,3)-α-D-GalNAc-(1,O)-(CH2)6CH=CH2ChEBI
Registry NumbersSources
Reaxys:21591251Reaxys
Citations