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BSP16

CAT: 0931-T61455-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T61455-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2727249-47-8
Target
Others, STING
Related Pathways
Others, Immunology/Inflammation
Bioactivity
BSP16 is a highly potent and orally active STING agonist, capable of selectively stimulating the interferon genes pathway. This compound, BSP16, holds great potential for cancer research [1].
Smiles
C(C[C@H](C(O)=O)CC)(=O)C1=CC=2C([Se]1)=CC(OC)=C(OC)C2
Molecular Formula
C16H18O5Se
Molecular Weight
369.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(2R)-4-(5,6-dimethoxy-1-benzoselenophen-2-yl)-2-ethyl-4-oxidanylidene-butanoic acid
CAS Number2727249-47-8
PubChem CID164946677
IUPAC Name(2R)-4-(5,6-dimethoxy-1-benzoselenophen-2-yl)-2-ethyl-4-oxobutanoic acid
Molecular FormulaC16H18O5Se
Molecular Weight369.3
Topological Polar Surface Area72.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity413
SMILES
CC[C@H](CC(=O)C1=CC2=CC(=C(C=C2[Se]1)OC)OC)C(=O)O
InChI
InChI=1S/C16H18O5Se/c1-4-9(16(18)19)5-11(17)15-7-10-6-12(20-2)13(21-3)8-14(10)22-15/h6-9H,4-5H2,1-3H3,(H,18,19)/t9-/m1/s1
InChIKey
BWQHPFYQJHFPHN-SECBINFHSA-N
Chemical Structure
2D Structure
2D structure of (2R)-4-(5,6-dimethoxy-1-benzoselenophen-2-yl)-2-ethyl-4-oxidanylidene-butanoic acid
CAS: 2727249-47-8
CID: 164946677
Formula: C16H18O5Se
MW: 369.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight369.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass370.03195
Monoisotopic Mass370.03195
Topological Polar Surface Area72.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity413
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

Alternative Products

CatalogName
HY-151264-01BSP16

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