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Thromboxane A2

CAT: 0931-T34862-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T34862-03Size:50 mg
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CAS Number
57576-52-0
Target
Others, Prostaglandin Receptor, Endogenous Metabolite
Related Pathways
Immunology/Inflammation, Others, GPCR/G Protein, Metabolism
Bioactivity
Thromboxane A2, as an unstable intermediate between the prostaglandin endoperoxides and thromboxane B2, is a potent inducer of platelet aggregation and causes vasoconstriction.
Smiles
C(/C=C\CCCC(O)=O)[C@H]1[C@@]2(C[C@@](O2)(O[C@@H]1/C=C/[C@H](CCCCC)O)[H])[H]
Molecular Formula
C20H32O5
Molecular Weight
352.47
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Thromboxane A2

Thromboxane A2 is a thromboxane which is produced by activated platelets and has prothrombotic properties: it stimulates activation of new platelets as well as increases platelet aggregation. It has a role as a mouse metabolite. It is an epoxy monocarboxylic acid and a thromboxanes A. It is a conjugate acid of a thromboxane A2(1-).

CAS Number57576-52-0
PubChem CID5280497
IUPAC Name(Z)-7-[(1S,3R,4S,5S)-3-[(E,3S)-3-hydroxyoct-1-enyl]-2,6-dioxabicyclo[3.1.1]heptan-4-yl]hept-5-enoic acid
Molecular FormulaC20H32O5
Molecular Weight352.5
XLogP3.4
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Heavy Atom Count25
Formal Charge0
Complexity459
SMILES
CCCCC[C@@H](/C=C/[C@@H]1[C@H]([C@@H]2C[C@@H](O2)O1)C/C=C\CCCC(=O)O)O
InChI
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18-14-20(24-17)25-18)10-7-4-5-8-11-19(22)23/h4,7,12-13,15-18,20-21H,2-3,5-6,8-11,14H2,1H3,(H,22,23)/b7-4-,13-12+/t15-,16+,17+,18-,20+/m0/s1
InChIKey
DSNBHJFQCNUKMA-SCKDECHMSA-N
Chemical Structure
2D Structure
2D structure of Thromboxane A2
CAS: 57576-52-0
CID: 5280497
Formula: C20H32O5
MW: 352.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight352.5
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Exact Mass352.22497412
Monoisotopic Mass352.22497412
Topological Polar Surface Area76 Ų
Heavy Atom Count25
Formal Charge0
Complexity459
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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