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Thromboxane B1

CAT: 0931-T73855-01Size: 100 µgDry Ice: NoHazardous: No
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CAT#:0931-T73855-01Size:100 µg
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CAS Number
64626-32-0
Target
Others, Prostaglandin Receptor
Related Pathways
GPCR/G Protein, Others, Immunology/Inflammation
Bioactivity
Thromboxane B1 (TXB1), a member of the Thromboxane B (TXB) family, is a lipid belonging to the eicosanoid family, recognized for its function in blood clot formation (thrombosis) [1].
Smiles
CCCCC[C@H](O)\C=C\[C@H]1OC(O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
Molecular Formula
C20H36O6
Molecular Weight
372.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Thromboxane B1

Thromboxane B1 is a thromboxane B that is thromboxane B2 in which the double bond at position 5-6 has been reduced to a single bond. It is a monocarboxylic acid and a thromboxanes B.

CAS Number64626-32-0
PubChem CID71668258
IUPAC Name7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]heptanoic acid
Molecular FormulaC20H36O6
Molecular Weight372.5
XLogP3.2
Topological Polar Surface Area107
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Heavy Atom Count26
Formal Charge0
Complexity411
SMILES
CCCCC[C@@H](/C=C/[C@@H]1[C@H]([C@H](CC(O1)O)O)CCCCCCC(=O)O)O
InChI
InChI=1S/C20H36O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h12-13,15-18,20-22,25H,2-11,14H2,1H3,(H,23,24)/b13-12+/t15-,16-,17-,18+,20?/m0/s1
InChIKey
JSDWWNLTJCCSAV-VZBVYBAISA-N
Chemical Structure
2D Structure
2D structure of Thromboxane B1
CAS: 64626-32-0
CID: 71668258
Formula: C20H36O6
MW: 372.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight372.5
XLogP33.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass372.25118886
Monoisotopic Mass372.25118886
Topological Polar Surface Area107 Ų
Heavy Atom Count26
Formal Charge0
Complexity411
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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HY-113445-01Thromboxane B3
MBS6098281-01Thromboxane B2
GTR19221593-01Thromboxane B1
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MBS8578457-01Thromboxane synthase
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