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CHEBI:62018 - [8)-α-Neu5Pr-(2→]4

ChEBI IDCHEBI:62018
ChEBI Name[8)-α-Neu5Pr-(2→]4
Stars
ASCII Name[8)-alpha-Neu5Pr-(2->]4
DefinitionAn N-propionylated α-(2→8)-linked homosialopolysaccharide consisting of four α-D-N-propionylneuraminyl residues joined by (2→8) linkages (i.e. [8)-α-Neu5Pr-(2→]n where n = 4).
Last Modified13 June 2011
SubmitterSteve
DownloadsMolfile
FormulaC48H78N4O33
Net Charge0
Average Mass1239.147
Monoisotopic Mass1238.45483
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H](CO)[C@@H](O)[C@]2([H])O[C@@](O[C@H](CO)[C@@H](O)[C@]3([H])O[C@@](O[C@H](CO)[C@@H](O)[C@]4([H])O[C@@](O)(C(=O)O)C[C@H](O)[C@H]4NC(=O)CC)(C(=O)O)C[C@H](O)[C@H]3NC(=O)CC)(C(=O)O)C[C@H](O)[C@H]2NC(=O)CC)(C(=O)O)C[C@H](O)[C@H]1NC(=O)CC
InChIInChI=1S/C48H78N4O33/c1-5-25(62)49-29-17(57)9-45(78,41(70)71)82-38(29)34(67)22(14-54)79-47(43(74)75)11-19(59)31(51-27(64)7-3)40(84-47)36(69)24(16-56)81-48(44(76)77)12-20(60)32(52-28(65)8-4)39(85-48)35(68)23(15-55)80-46(42(72)73)10-18(58)30(50-26(63)6-2)37(83-46)33(66)21(61)13-53/h17-24,29-40,53-61,66-69,78H,5-16H2,1-4H3,(H,49,62)(H,50,63)(H,51,64)(H,52,65)(H,70,71)(H,72,73)(H,74,75)(H,76,77)/t17-,18-,19-,20-,21+,22+,23+,24+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,45+,46+,47+,48+/m0/s1
InChIKeyMOGWYQQKWNBZGN-PJRFNICESA-N
ChEBI Ontology
Outgoing Relation(s)
[8)-α-Neu5Pr-(2→]4 (CHEBI:62018) is a [8)-α-Neu5Pr-(2→]n (CHEBI:62297)
[8)-α-Neu5Pr-(2→]4 (CHEBI:62018) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Name 
3,5-dideoxy-5-propanamido-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→8)-3,5-dideoxy-5-propanamido-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→8)-3,5-dideoxy-5-propanamido-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→8)-3,5-dideoxy-5-propanamido-D-glycero-α-D-galacto-non-2-ulopyranosonic acid
Synonyms  Source
[α-NeuNPr-(2→8)]4ChEBI
α-Neu5Pr-(2→8)-α-Neu5Pr-(2→8)-α-Neu5Pr-(2→8)-α-Neu5PrChEBI
(NeuPr)-4ChEBI
Citations