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Heparin (Lithium salt)

CAT: 0957-E6015-250mgSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0957-E6015-250mgSize:250 mg
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CAS Number
9045-22-1
Target
Others
Applications
Others
Additionnal Information
Heparin Lithium salt is an anticoagulant that binds reversibly to antithrombin III (ATIII) . Heparin Lithium salt is used as an anticoagulant for laboratory studies and in direct membrane-feeding assays.

Chemical Information

heparin, lithium salt
CAS Number9045-22-1
PubChem CID44336410
IUPAC Name4-hydroxy-6-[4-hydroxy-6-methoxy-5-(sulfoamino)-2-(sulfooxymethyl)oxan-3-yl]oxy-3-methoxy-5-sulfooxyoxane-2-carboxylic acid
Molecular FormulaC14H25NO20S3
Molecular Weight623.5
XLogP-5.4
Topological Polar Surface Area343
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count12
Heavy Atom Count38
Formal Charge0
Complexity1120
SMILES
COC1C(C(C(OC1C(=O)O)OC2C(OC(C(C2O)NS(=O)(=O)O)OC)COS(=O)(=O)O)OS(=O)(=O)O)O
InChI
InChI=1S/C14H25NO20S3/c1-29-9-7(17)10(35-38(26,27)28)14(34-11(9)12(18)19)33-8-4(3-31-37(23,24)25)32-13(30-2)5(6(8)16)15-36(20,21)22/h4-11,13-17H,3H2,1-2H3,(H,18,19)(H,20,21,22)(H,23,24,25)(H,26,27,28)
InChIKey
HXSDFQWQRCUQHF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of heparin, lithium salt
CAS: 9045-22-1
CID: 44336410
Formula: C14H25NO20S3
MW: 623.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight623.5
XLogP3-5.4
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count21
Rotatable Bond Count12
Exact Mass623.01320571
Monoisotopic Mass623.01320571
Topological Polar Surface Area343 Ų
Heavy Atom Count38
Formal Charge0
Complexity1120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count10
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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