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CHEBI:138716 - HP_dp02_0003

ChEBI IDCHEBI:138716
ChEBI NameHP_dp02_0003
Stars
DefinitionA heparin disaccharide that is N-sulfo-α-D-glucosamine in which the hydroxy group at position 4 has been glycosylated by α-L-idopyranuronic acid. Sequence: IdoA-GlcNSO3.
Last Modified10 February 2025
Submitterricardblum
DownloadsMolfile
FormulaC12H21NO14S
Net Charge0
Average Mass435.360
Monoisotopic Mass435.06828
SMILESO=C(O)[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](NS(=O)(=O)O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C12H21NO14S/c14-1-2-8(4(15)3(11(21)25-2)13-28(22,23)24)26-12-7(18)5(16)6(17)9(27-12)10(19)20/h2-9,11-18,21H,1H2,(H,19,20)(H,22,23,24)/t2-,3-,4-,5+,6+,7-,8-,9-,11+,12-/m1/s1
InChIKeyKNKWELGWBDSUOG-PNRHKHKDSA-N
ChEBI Ontology
Outgoing Relation(s)
HP_dp02_0003 (CHEBI:138716) is a amino disaccharide (CHEBI:22480)
HP_dp02_0003 (CHEBI:138716) is a heparin disaccharide (CHEBI:138729)
HP_dp02_0003 (CHEBI:138716) is a sulfamic acids (CHEBI:35719)
Incoming Relation(s)
HP_dp02_0002 (CHEBI:138717) has functional parent HP_dp02_0003 (CHEBI:138716)
HP_dp02_0005 (CHEBI:138714) has functional parent HP_dp02_0003 (CHEBI:138716)
IUPAC Name 
2-deoxy-4-O-α-L-idopyranuronosyl-2-(sulfoamino)-α-D-glucopyranose
Synonyms  Source
alpha-L-IdopA(1-4)alpha-D-GlcpNSIUPAC
α-L-IdopA(1-4)α-D-GlcpNSChEBI
Manual XrefsDatabases
G97423JAGlyTouCan
G97423JAGlyGen
Citations