Products for Research Use Only
RegisterLogin

Barlerin

CAT: 0013-GTR19168858-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19168858-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Barlerin
CAS Number
57420-46-9
Product Name Alternative
Caspase, Akt, 8-O-Acetylshanzhiside methyl ester, Barlerin, inhibit, Inhibitor, Nuclear factor-κB, Nuclear factor-kappaB, NF-κB, NF-Κb, NFκB, NF-kB, NFkB, ND 01, ND01, ND-01, VEGFR, TNF-α
Field of Research
Cardiovascular Research, Cell Biology, Protein Biochemistry, Signal Transduction
Purity
≥95% (May vary between batches)
Solubility
DMSO:82 mg/mL (182.86 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (7.36 mM)
Smiles
COC (=O) C1=CO[C@@H] (O[C@@H]2O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]2O) [C@H]2[C@@H]1[C@H] (O) C[C@]2 (C) OC (C) =O
Molecular Formula
C19H28O12
Molecular Weight
448.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Barlerin

8-O-Acetylshanzhiside methyl ester has been reported in Barleria lupulina, Lamium garganicum, and other organisms with data available.

CAS Number57420-46-9
PubChem CID162823
IUPAC Namemethyl (1S,4aS,5R,7S,7aS)-7-acetyloxy-5-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
Molecular FormulaC19H28O12
Molecular Weight448.4
XLogP-2
Topological Polar Surface Area181
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Heavy Atom Count31
Formal Charge0
Complexity725
SMILES
CC(=O)O[C@]1(C[C@H]([C@H]2[C@@H]1[C@@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C
InChI
InChI=1S/C19H28O12/c1-7(21)31-19(2)4-9(22)11-8(16(26)27-3)6-28-17(12(11)19)30-18-15(25)14(24)13(23)10(5-20)29-18/h6,9-15,17-18,20,22-25H,4-5H2,1-3H3/t9-,10-,11+,12-,13-,14+,15-,17+,18+,19+/m1/s1
InChIKey
ARFRZOLTIRQFCI-NGQYDJQZSA-N
Chemical Structure
2D Structure
2D structure of Barlerin
CAS: 57420-46-9
CID: 162823
Formula: C19H28O12
MW: 448.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.4
XLogP3-2
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Exact Mass448.15807632
Monoisotopic Mass448.15807632
Topological Polar Surface Area181 Ų
Heavy Atom Count31
Formal Charge0
Complexity725
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19199456-01Barthrin
GTR19087013-01Recombinant Methanosarcina barkeri Cobalamin synthase (cobS)
GTR19095445-01Recombinant Methanosarcina barkeri UPF0290 protein Mbar_A3516 (Mbar_A3516)
GTR19096939-01Recombinant Methanosarcina barkeri Protein CrcB homolog 3 (crcB3)
GTR19097625-01Recombinant Methanosarcina barkeri Protein CrcB homolog 1 (crcB1)
GTR19089457-01Recombinant Methanosarcina barkeri UPF0059 membrane protein Mbar_A0247 (Mbar_A0247)
GTR19097329-01Recombinant Methanosarcina barkeri Protein CrcB homolog 2 (crcB2)
GTR19112669-01Recombinant Methanosarcina barkeri Tetrahydromethanopterin S-methyltransferase subunit G (mtrG)
GTR19109677-01Recombinant Methanosarcina barkeri Tetrahydromethanopterin S-methyltransferase subunit B (mtrB)
GTR19088390-01Recombinant Methanosarcina barkeri Putative cobalt transport protein CbiM 1 (cbiM1)

Alternative Products

CatalogName
HY-N0758-01Barlerin
HY-N0758RBarlerin (Standard)

Popular Products