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CHEBI:64184 - 3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc

ChEBI IDCHEBI:64184
ChEBI Name3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc
Stars
ASCII Name3-O-Ac-alpha-D-GalpANAc-(1->4)-3-O-Ac-alpha-D-GalpANAc-(1->4)-3-O-Ac-alpha-D-GalpANAc
DefinitionA linear amino trisaccharide that consists of three 2-acetamido-3-O-acetyl-2-deoxy-α-D-galactopyranuronosyl units joined by (1→4)-linkages.
Last Modified15 March 2012
SubmitterSteve
DownloadsMolfile
FormulaC30H41N3O22
Net Charge0
Average Mass795.657
Monoisotopic Mass795.21817
SMILESCC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@@H](O[C@H]2O[C@H](C(=O)O)[C@H](O[C@H]3O[C@H](C(=O)O)[C@H](O)[C@H](OC(C)=O)[C@H]3NC(C)=O)[C@H](OC(C)=O)[C@H]2NC(C)=O)[C@@H](C(=O)O)O[C@@H]1O
InChIInChI=1S/C30H41N3O22/c1-7(34)31-13-18(49-11(5)38)21(23(26(43)44)51-28(13)47)53-30-15(33-9(3)36)19(50-12(6)39)22(24(55-30)27(45)46)54-29-14(32-8(2)35)17(48-10(4)37)16(40)20(52-29)25(41)42/h13-24,28-30,40,47H,1-6H3,(H,31,34)(H,32,35)(H,33,36)(H,41,42)(H,43,44)(H,45,46)/t13-,14-,15-,16-,17-,18-,19-,20+,21-,22-,23+,24+,28+,29-,30+/m1/s1
InChIKeyQZSHSFYUOYWTDA-WERLSDIYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc (CHEBI:64184) is a amino trisaccharide (CHEBI:59266)
3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc-(1→4)-3-O-Ac-α-D-GalpANAc (CHEBI:64184) is a carbohydrate acid derivative (CHEBI:63436)
IUPAC Name 
2-acetamido-3-O-acetyl-2-deoxy-α-D-galactopyranuronosyl-(1→4)-2-acetamido-3-O-acetyl-2-deoxy-α-D-galactopyranuronosyl-(1→4)-2-acetamido-3-O-acetyl-2-deoxy-α-D-galactopyranuronic acid
Synonyms  Source
[4)-3-O-Ac-α-D-GalpANAc(1→]3ChEBI
3-O-Ac-α-D-GalANAc-(1→4)-3-O-Ac-α-D-GalANAc-(1→4)-3-O-Ac-α-D-GalANAcChEBI
Citations