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BMP-22

CAT: 0013-GTR19191554-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19191554-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BMP-22 is a potent and selective autotaxin inhibitor (IC50 = 170 nM) that suppresses LPA production in vitro and reduces cancer cell invasion. In vivo, it demonstrates anti-metastatic activity by decreasing lung tumor foci in a mouse melanoma model at 0.5 mg/kg/day.
CAS Number
1306684-90-1
Field of Research
Metabolism Research
Smiles
C (CCCCCCCCCCCCCC) C1=CC=C (CP (=O) (O) O) C=C1
Molecular Formula
C22H39O3P
Molecular Weight
382.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-Pentadecylbenzylphosphonic acid

structure in first source

CAS Number1306684-90-1
PubChem CID59054073
IUPAC Name(4-pentadecylphenyl)methylphosphonic acid
Molecular FormulaC22H39O3P
Molecular Weight382.5
XLogP7.7
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Heavy Atom Count26
Formal Charge0
Complexity358
SMILES
CCCCCCCCCCCCCCCC1=CC=C(C=C1)CP(=O)(O)O
InChI
InChI=1S/C22H39O3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21-16-18-22(19-17-21)20-26(23,24)25/h16-19H,2-15,20H2,1H3,(H2,23,24,25)
InChIKey
XWVBRTAQHMKHCE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Pentadecylbenzylphosphonic acid
CAS: 1306684-90-1
CID: 59054073
Formula: C22H39O3P
MW: 382.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.5
XLogP37.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Exact Mass382.26368210
Monoisotopic Mass382.26368210
Topological Polar Surface Area57.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity358
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

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