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Blapsin B

CAT: 0931-T68529-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T68529-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
861145-00-8
Target
Others
Related Pathways
Others
Bioactivity
Blapsin B is a potent 14-3-3 inhibitor. Blapsin B is a naturally occurring compound isolated from the ethanol extract of the stink beetle, Blaps japanensis. Blapsin B potently inhibited 14-3-3 protein-protein interactions (PPIs) with IC (50) value of 10.0 μM as determined by an ELISA assay, and 2.5 μM in an FP assay, respectively. Blapsin B represent the first example of natural small-molecule 14-3-3 inhibitors.
Smiles
OC=1C=C2C(OCCC2=CC1O)C3=CC(O)=C(O)C=C3
Molecular Formula
C15H14O5
Molecular Weight
274.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Blapsin B

antineoplastic from the insect Blaps japanensis

CAS Number861145-00-8
PubChem CID60168276
IUPAC Name1-(3,4-dihydroxyphenyl)-3,4-dihydro-1H-isochromene-6,7-diol
Molecular FormulaC15H14O5
Molecular Weight274.27
XLogP1.9
Topological Polar Surface Area90.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity336
SMILES
C1COC(C2=CC(=C(C=C21)O)O)C3=CC(=C(C=C3)O)O
InChI
InChI=1S/C15H14O5/c16-11-2-1-9(6-12(11)17)15-10-7-14(19)13(18)5-8(10)3-4-20-15/h1-2,5-7,15-19H,3-4H2
InChIKey
OLEHILHKGHOVLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Blapsin B
CAS: 861145-00-8
CID: 60168276
Formula: C15H14O5
MW: 274.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight274.27
XLogP31.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass274.08412354
Monoisotopic Mass274.08412354
Topological Polar Surface Area90.2 Ų
Heavy Atom Count20
Formal Charge0
Complexity336
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5811090Blapsin B

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