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Lanopepden (mesylate)

CAT: 0804-HY-116598Size: 1 EachDry Ice: NoHazardous: No
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Description
Lanopepden mesylate (GSK 1322322 mesylate) is a peptide deformase (PDF) inhibitor. Lanopepden mesylate has antibacterial activity by inhibiting the activity of PDF, preventing the correct synthesis of bacterial proteins. Lanopepden mesylate mainly targets Gram-positive bacteria. Lanopepden mesylate can be used in the study of acute bacterial skin and skin structural infections[1].
CAS Number
1441390-17-5
Product Name Alternative
GSK 1322322 (mesylate)
UNSPSC
12352005
Target
Bacterial
Type
Reference compound
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/lanopepden-mesylate.html
Smiles
O=C([C@H](CC1CCCC1)CN(O)C=O)NNC2=NC(C)=NC(N3C[C@]4(COCCN4CC3)[H])=C2F.OS(C)(=O)=O
Molecular Formula
C23H38FN7O7S
Molecular Weight
575.65
References & Citations
[1]Lee H Y, et al. Identification of novel aminopiperidine derivatives for antibacterial activity against Gram-positive bacteria[J]. Bioorganic & Medicinal Chemistry Letters, 2016, 26 (13) : 3148-3152.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
Phase 2

Chemical Information

Lanopepden Mesylate
CAS Number1441390-17-5
PubChem CID71571564
IUPAC NameN-[(2R)-3-[2-[6-[(9aS)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazin-8-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazinyl]-2-(cyclopentylmethyl)-3-oxopropyl]-N-hydroxyformamide;methanesulfonic acid
Molecular FormulaC23H38FN7O7S
Molecular Weight575.7
Topological Polar Surface Area186
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Heavy Atom Count39
Formal Charge0
Complexity778
SMILES
CC1=NC(=C(C(=N1)N2CCN3CCOC[C@@H]3C2)F)NNC(=O)[C@H](CC4CCCC4)CN(C=O)O.CS(=O)(=O)O
InChI
InChI=1S/C22H34FN7O4.CH4O3S/c1-15-24-20(19(23)21(25-15)29-7-6-28-8-9-34-13-18(28)12-29)26-27-22(32)17(11-30(33)14-31)10-16-4-2-3-5-16;1-5(2,3)4/h14,16-18,33H,2-13H2,1H3,(H,27,32)(H,24,25,26);1H3,(H,2,3,4)/t17-,18+;/m1./s1
InChIKey
UNGNACZMQRGYNV-URBRKQAFSA-N
Chemical Structure
2D Structure
2D structure of Lanopepden Mesylate
CAS: 1441390-17-5
CID: 71571564
Formula: C23H38FN7O7S
MW: 575.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight575.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count13
Rotatable Bond Count8
Exact Mass575.25374591
Monoisotopic Mass575.25374591
Topological Polar Surface Area186 Ų
Heavy Atom Count39
Formal Charge0
Complexity778
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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A21351-1Lanopepden 1mg
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A21351-10Lanopepden 10mg
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