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SBP-3

CAT: 0013-GTR19292597-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19292597-02Size:50 mg
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Description
SBP-3 is a bioluminescent probe designed for sulfite detection via a specific intramolecular cleavage reaction. It enables sensitive monitoring of sulfite dynamics in both in vitro assays and in vivo imaging studies, supporting research in biochemistry, environmental science, and pathophysiology.
CAS Number
2494035-93-5
Molecular Weight
406.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(4S)-2-[6-(6-oxoheptanoyloxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid
CAS Number2494035-93-5
PubChem CID163408892
IUPAC Name(4S)-2-[6-(6-oxoheptanoyloxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid
Molecular FormulaC18H18N2O5S2
Molecular Weight406.5
XLogP2.6
Topological Polar Surface Area159
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Heavy Atom Count27
Formal Charge0
Complexity627
SMILES
CC(=O)CCCCC(=O)OC1=CC2=C(C=C1)N=C(S2)C3=N[C@H](CS3)C(=O)O
InChI
InChI=1S/C18H18N2O5S2/c1-10(21)4-2-3-5-15(22)25-11-6-7-12-14(8-11)27-17(19-12)16-20-13(9-26-16)18(23)24/h6-8,13H,2-5,9H2,1H3,(H,23,24)/t13-/m1/s1
InChIKey
MCWKUGBURYJGKE-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of (4S)-2-[6-(6-oxoheptanoyloxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid
CAS: 2494035-93-5
CID: 163408892
Formula: C18H18N2O5S2
MW: 406.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight406.5
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass406.06571403
Monoisotopic Mass406.06571403
Topological Polar Surface Area159 Ų
Heavy Atom Count27
Formal Charge0
Complexity627
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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