Products for Research Use Only

Col003

CAT: 0013-GTR19176861-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19176861-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Col003 is a potent and selective Hsp47 inhibitor that competitively targets its collagen-binding site with an IC50 of 1.8 μM. This small molecule is a valuable research tool for studying fibrosis mechanisms in both cellular and animal models.
CAS Number
328565-16-8
Product Name Alternative
Structure, triple, Col 003, Col003, Col-003, collagen, Hsp47, HSP47, HSP, Inhibitor, interaction, Heat shock proteins, helix, MEF, inhibit, secretion
Field of Research
Metabolism Research, Signal Transduction
Purity
98.67% (May vary between batches)
Solubility
DMSO:188 mg/mL (730.84 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (7.77 mM)
Smiles
Oc1c (C=O) cc (Cc2ccccc2) cc1[N+] ([O-]) =O
Molecular Formula
C14H11NO4
Molecular Weight
257.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-Benzyl-2-hydroxy-3-nitrobenzaldehyde
CAS Number328565-16-8
PubChem CID871077
IUPAC Name5-benzyl-2-hydroxy-3-nitrobenzaldehyde
Molecular FormulaC14H11NO4
Molecular Weight257.24
XLogP3.3
Topological Polar Surface Area83.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity322
SMILES
C1=CC=C(C=C1)CC2=CC(=C(C(=C2)[N+](=O)[O-])O)C=O
InChI
InChI=1S/C14H11NO4/c16-9-12-7-11(6-10-4-2-1-3-5-10)8-13(14(12)17)15(18)19/h1-5,7-9,17H,6H2
InChIKey
RKJXVCLOGNLZOI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Benzyl-2-hydroxy-3-nitrobenzaldehyde
CAS: 328565-16-8
CID: 871077
Formula: C14H11NO4
MW: 257.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight257.24
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass257.06880783
Monoisotopic Mass257.06880783
Topological Polar Surface Area83.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity322
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes