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CHEBI:138719 - HP_dp02_0001

ChEBI IDCHEBI:138719
ChEBI NameHP_dp02_0001
Stars
DefinitionA heparin disaccharide that is 6-O-sulfo-α-D-glucosamine in which the hydroxy group at position 4 has been glycosylated by 2-O-sulfo-α-L-idopyranuronic acid. Sequence: IdoA(2-OSO3)-GlcN(6-OSO3).
Last Modified1 December 2017
Submitterricardblum
DownloadsMolfile
FormulaC12H21NO17S2
Net Charge0
Average Mass515.424
Monoisotopic Mass515.02509
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]2OS(=O)(=O)O)[C@@H](COS(=O)(=O)O)O[C@@H]1O
InChIInChI=1S/C12H21NO17S2/c13-3-4(14)7(2(27-11(3)19)1-26-31(20,21)22)28-12-9(30-32(23,24)25)6(16)5(15)8(29-12)10(17)18/h2-9,11-12,14-16,19H,1,13H2,(H,17,18)(H,20,21,22)(H,23,24,25)/t2-,3-,4-,5+,6+,7-,8-,9-,11+,12-/m1/s1
InChIKeyIEIRYMLRVZKPTD-PNRHKHKDSA-N
ChEBI Ontology
Outgoing Relation(s)
HP_dp02_0001 (CHEBI:138719) is a amino disaccharide (CHEBI:22480)
HP_dp02_0001 (CHEBI:138719) is a heparin disaccharide (CHEBI:138729)
HP_dp02_0001 (CHEBI:138719) is a oligosaccharide sulfate (CHEBI:37909)
IUPAC Name 
2-amino-2-deoxy-6-O-sulfo-4-O-(2-O-sulfo-α-L-idopyranuronosyl)-α-D-glucopyranose
Synonyms  Source
alpha-L-IdopA(2S)-(1-4)-alpha-D-GlcpN(6S)IUPAC
α-L-IdopA(2S)-(1-4)-α-D-GlcpN(6S)IUPAC
Manual XrefsDatabases
G70805NPGlyTouCan
Citations