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Chemical structure of 2,3-dinor Thromboxane B1

GC42065

2,3-dinor Thromboxane B1

Also known as 5-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]pentanoic acid

Thromboxane B2 (TXB2) is released in substantial quantities from aggregating platelets and metabolized during circulation to 11-dehydro TXB2 and 2,3-dinor TXB2

ChemicalCAS196493-76-2MW344.4FormulaC18H32O6
CAS number
196493-76-2
Molecular weight
344.4
Formula
C18H32O6
Solubility
DMF： 50 mg/ml,DMSO： 20 mg/ml,Ethanol： 50 mg/ml,PBS (pH 7·2)： ·15 mg/ml
InChIKey
LGWCOUWMTAQMQT-QCBHMXSDSA-N
Catalogue number
GC42065
Brand
GLPBIO
Computed properties PubChem CID 101668701 · XLogP 2.1 · TPSA 107 Ų · H-bond donors 4
XLogP
2.1
TPSA
107 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
24

SMILES CCCCC[C@@H](/C=C/[C@@H]1[C@H]([C@H](CC(O1)O)O)CCCCC(=O)O)O

Computed descriptors from PubChem (CID 101668701), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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