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CHEBI:235507 - 5-aminopentyl 2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp-(1→4)-2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp

ChEBI IDCHEBI:235507
ChEBI Name5-aminopentyl 2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp-(1→4)-2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp
Stars
ASCII Name5-aminopentyl 2-acetamido-2-deoxy-beta-D-Manp-(1->4)-2-acetamido-3-O-acetyl-2,6-dideoxy-alpha-L-Galp-(1->3)-2-acetamido-2,6-dideoxy-beta-D-Galp-(1->4)-2-acetamido-2-deoxy-beta-D-Manp-(1->4)-2-acetamido-3-O-acetyl-2,6-dideoxy-alpha-L-Galp-(1->3)-2-acetamido-2,6-dideoxy-beta-D-Galp
Last Modified23 September 2025
SubmitterAdnan
DownloadsMolfile
FormulaC57H91N7O31
Net Charge0
Average Mass1370.373
Monoisotopic Mass1369.57595
SMILESCC(=O)N[C@@H]1[C@H](O[C@H]2[C@@H](OC(C)=O)[C@H](NC(C)=O)[C@H](O[C@H]3[C@@H](O)[C@@H](C)O[C@@H](OCCCCCN)[C@@H]3NC(C)=O)O[C@H]2C)O[C@H](C(=O)O)[C@@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O[C@@H]3O[C@@H](C)[C@@H](O[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@@H]4NC(C)=O)[C@@H](OC(C)=O)[C@@H]3NC(C)=O)[C@H]2NC(C)=O)[C@@H]1O
InChIInChI=1S/C57H91N7O31/c1-18-36(73)43(32(61-24(7)67)52(83-18)82-17-15-13-14-16-58)91-56-34(63-26(9)69)46(88-29(12)72)42(21(4)85-56)90-54-31(60-23(6)66)39(76)47(49(95-54)51(80)81)93-55-33(62-25(8)68)44(37(74)19(2)84-55)92-57-35(64-27(10)70)45(87-28(11)71)41(20(3)86-57)89-53-30(59-22(5)65)38(75)40(77)48(94-53)50(78)79/h18-21,30-49,52-57,73-77H,13-17,58H2,1-12H3,(H,59,65)(H,60,66)(H,61,67)(H,62,68)(H,63,69)(H,64,70)(H,78,79)(H,80,81)/t18-,19-,20+,21+,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40+,41-,42-,43-,44-,45+,46+,47+,48+,49+,52-,53-,54-,55+,56+,57+/m1/s1
InChIKeyDUNOKPFICFOTPS-QWNSDMKZSA-N
Roles Classification
Biological Role:
epitope  The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
ChEBI Ontology
Outgoing Relation(s)
5-aminopentyl 2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp-(1→4)-2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp (CHEBI:235507) has role epitope (CHEBI:53000)
5-aminopentyl 2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp-(1→4)-2-acetamido-2-deoxy-β-D-Manp-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-Galp-(1→3)-2-acetamido-2,6-dideoxy-β-D-Galp (CHEBI:235507) is a amino hexasaccharide (CHEBI:61855)
IUPAC Name 
5-aminopentyl 2-acetamido-2-deoxy-β-D-mannopyranuronosyl-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-galactopyranosyl-(1→3)-2-acetamido-2,6-dideoxy-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-mannopyranuronosyl-(1→4)-2-acetamido-3-O-acetyl-2,6-dideoxy-α-L-galactopyranosyl-(1→3)-2-acetamido-2,6-dideoxy-β-D-galactopyranoside
Synonym  Source
CP5-O-Ac-HexasaccharideChEBI
Citations