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Boc-MLF

CAT: 1410-M30741-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M30741-04Size:25 mg
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Description
Antagonist of formyl peptide receptor 1 (FPR1) . Reduces superoxide production induced by fMLF with an EC50 of 0.63 μM. Almost completely blocks fMLF-stimulated primary granule exocytosis.
CAS Number
67247-12-5
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
509.66
Molecular Formula
C25H39N3O6S
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Boc-Met-Leu-Phe-OH
CAS Number67247-12-5
PubChem CID14655143
IUPAC Name(2S)-2-[[(2S)-4-methyl-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoyl]amino]pentanoyl]amino]-3-phenylpropanoic acid
Molecular FormulaC25H39N3O6S
Molecular Weight509.7
XLogP2.9
Topological Polar Surface Area159
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count15
Heavy Atom Count35
Formal Charge0
Complexity704
SMILES
CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)OC(C)(C)C
InChI
InChI=1S/C25H39N3O6S/c1-16(2)14-19(22(30)27-20(23(31)32)15-17-10-8-7-9-11-17)26-21(29)18(12-13-35-6)28-24(33)34-25(3,4)5/h7-11,16,18-20H,12-15H2,1-6H3,(H,26,29)(H,27,30)(H,28,33)(H,31,32)/t18-,19-,20-/m0/s1
InChIKey
GYBXWOPENJVQKE-UFYCRDLUSA-N
Chemical Structure
2D Structure
2D structure of Boc-Met-Leu-Phe-OH
CAS: 67247-12-5
CID: 14655143
Formula: C25H39N3O6S
MW: 509.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight509.7
XLogP32.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count15
Exact Mass509.25595715
Monoisotopic Mass509.25595715
Topological Polar Surface Area159 Ų
Heavy Atom Count35
Formal Charge0
Complexity704
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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