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CHEBI:62019 - [8)-α-Neu5Pr-(2→]5

ChEBI IDCHEBI:62019
ChEBI Name[8)-α-Neu5Pr-(2→]5
Stars
ASCII Name[8)-alpha-Neu5Pr-(2->]5
DefinitionAn N-propionylated α-(2→8)-linked homosialopolysaccharide consisting of five α-D-N-propionylneuraminyl residues joined by (2→8) linkages (i.e. [8)-α-Neu5Pr-(2→]n where n = 5).
Last Modified13 June 2011
SubmitterSteve
DownloadsMolfile
FormulaC60H97N5O41
Net Charge0
Average Mass1544.430
Monoisotopic Mass1543.56590
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@H](CO)[C@@H](O)[C@]5([H])O[C@@](O)(C(=O)O)C[C@H](O)[C@H]5NC(=O)CC)(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/C60H97N5O41/c1-6-31(77)61-36-21(71)11-56(97,51(87)88)102-47(36)42(83)27(17-67)98-58(53(91)92)13-23(73)38(63-33(79)8-3)49(104-58)44(85)29(19-69)100-60(55(95)96)15-25(75)40(65-35(81)10-5)50(106-60)45(86)30(20-70)101-59(54(93)94)14-24(74)39(64-34(80)9-4)48(105-59)43(84)28(18-68)99-57(52(89)90)12-22(72)37(62-32(78)7-2)46(103-57)41(82)26(76)16-66/h21-30,36-50,66-76,82-86,97H,6-20H2,1-5H3,(H,61,77)(H,62,78)(H,63,79)(H,64,80)(H,65,81)(H,87,88)(H,89,90)(H,91,92)(H,93,94)(H,95,96)/t21-,22-,23-,24-,25-,26+,27+,28+,29+,30+,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,50+,56+,57+,58+,59+,60+/m0/s1
InChIKeyANGMGCAYESOJOY-NUFSHTTDSA-N
ChEBI Ontology
Outgoing Relation(s)
[8)-α-Neu5Pr-(2→]5 (CHEBI:62019) is a [8)-α-Neu5Pr-(2→]n (CHEBI:62297)
[8)-α-Neu5Pr-(2→]5 (CHEBI:62019) is a amino pentasaccharide (CHEBI:59268)
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-ulopyranonosyl-(2→8)-3,5-dideoxy-5-propanamido-D-glycero-α-D-galacto-non-2-ulopyranosonic acid
Synonyms  Source
[α-NeuNPr-(2→8)]5ChEBI
(NeuPr)-5ChEBI
α-Neu5Pr-(2→8)-α-Neu5Pr-(2→8)-α-Neu5Pr-(2→8)-α-Neu5Pr-(2→8)-α-Neu5PrChEBI
Citations