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Inhibitor Report for: Heparin-disaccharide

Heparin is a naturally occurring anticoagulant produced by basophils and mast cells. Heparin is a polymer of varying chain size. In therapeutic doses, it acts as an anticoagulant, preventing the formation of clots


General
Type Sulfur Compound
Chemical_Nomenclature (2R,3R,4S)-2-[(2R,3S,4R,5R,6S)-4,6-dihydroxy-5-(sulfoamino)-2-(sulfooxymethyl)oxan-3-yl]oxy-4-hydroxy-3-sulfooxy-3,4-dihydro-2H-pyran-6-carboxylic acid
Canonical SMILES C1=C(OC(C(C1O)OS(=O)(=O)O)OC2C(OC(C(C2O)NS(=O)(=O)O)O)COS(=O)(=O)O)C(=O)O
InChI InChI=1S/C12H19NO19S3/c14-3-1-4(10(16)17)30-12(8(3)32-35(25,26)27)31-9-5(2-28-34(22,23)24)29-11(18)6(7(9)15)13-33(19,20)21/h1,3,5-9,11-15,18H,2H2,(H,16,17)(H,19,20,21)(H,22,23,24)(H,25,26,27)/t3-,5+,6+,7+,8+,9+,11-,12-/m0/s1
InChIKey LRPGJWKAYQRIAQ-GYBHJADLSA-N
Other name(s) Heparin disaccharide I-S ; H1S ; AC1L9MEK ; HP_dp02_0009 ; CHEBI:138683 ; Alpha-delta4,5-UA(2S)-(1-4)-alpha-D-GlcpNS(6S)
________________________________________________________________________________________________
MW|577.45
Formula|C12H19NO19S3
CAS_number|
PubChem|448837
UniChem|LRPGJWKAYQRIAQ-GYBHJADLSA-N
IUPHAR|
Wikipedia|Heparin

Target
Families | Heparin-disaccharide ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 4UYW: Structure of the wnt deacetylase notum - Crystal form I heparin complex - 1.7A
Protein | human-NOTUM

References:
Search PubMed for references concerning: Heparin-disaccharide
    Title: Notum deacylates Wnt proteins to suppress signalling activity
    Kakugawa S, Langton PF, Zebisch M, Howell SA, Chang TH, Liu Y, Feizi T, Bineva G, O'Reilly N and Vincent JP <2 more author(s)>
    Ref: Nature, 519:187, 2015 : PubMed