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CHEBI:138713 - HP_dp02_0006

ChEBI IDCHEBI:138713
ChEBI NameHP_dp02_0006
Stars
DefinitionA heparin disaccharide that is 6-O-sulfo-α-D-glucosamine in which the hydroxy group at position 4 has been glycosylated by α-L-idopyranuronic acid. Sequence: IdoA-GlcN(6-OSO3).
Last Modified1 December 2017
Submitterricardblum
DownloadsMolfile
FormulaC12H21NO14S
Net Charge0
Average Mass435.360
Monoisotopic Mass435.06828
SMILESN[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](COS(=O)(=O)O)O[C@@H]1O
InChIInChI=1S/C12H21NO14S/c13-3-4(14)8(2(25-11(3)20)1-24-28(21,22)23)26-12-7(17)5(15)6(16)9(27-12)10(18)19/h2-9,11-12,14-17,20H,1,13H2,(H,18,19)(H,21,22,23)/t2-,3-,4-,5+,6+,7-,8-,9-,11+,12-/m1/s1
InChIKeyANMMIMZMRLYNGB-PNRHKHKDSA-N
ChEBI Ontology
Outgoing Relation(s)
HP_dp02_0006 (CHEBI:138713) is a amino disaccharide (CHEBI:22480)
HP_dp02_0006 (CHEBI:138713) is a heparin disaccharide (CHEBI:138729)
HP_dp02_0006 (CHEBI:138713) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name 
2-amino-2-deoxy-4-O-α-L-idopyranuronosyl-6-O-sulfo-α-D-glucopyranose
Synonyms  Source
alpha-L-IdopA-(1-4)-alpha-D-GlcpN(6S)IUPAC
αLIdopA-(1-4)-α-D-GlcpN(6S)IUPAC
Manual XrefsDatabases
G76925AYGlyTouCan
Citations