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Cetilistat (Standard)

CAT: 0804-HY-14471R-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-14471R-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Cetilistat (Standard) is the analytical standard of Cetilistat. This product is intended for research and analytical applications. Cetilistat (ATL-962), an inhibitor of pancreatic lipase, acts as an effective anti-obesity agent. Cetilistat inhibits rat and human pancreatic lipase activity with IC50s of 54.8 nM, and 5.95 nM, respectively[1].
CAS Number
282526-98-1
Product Name Alternative
ATL-962 (Standard)
UNSPSC
12352005
Target
Lipase; Reference Standards
Type
Reference Standards
Related Pathways
Metabolic Enzyme/Protease; Others
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/cetilistat-standard.html
Smiles
CC1=CC=C(N=C(OCCCCCCCCCCCCCCCC)OC2=O)C2=C1
Molecular Formula
C25H39NO3
Molecular Weight
401.58
References & Citations
[1]Yamada Y, et al. Cetilistat (ATL-962), a novel pancreatic lipase inhibitor, ameliorates body weight gain and improves lipid profiles in rats. Horm Metab Res. 2008 Aug;40 (8) :539-43.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Cetilistat

Cetilistat is a benzoxazine.

CAS Number282526-98-1
PubChem CID9952916
IUPAC Name2-hexadecoxy-6-methyl-3,1-benzoxazin-4-one
Molecular FormulaC25H39NO3
Molecular Weight401.6
XLogP9.8
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count16
Heavy Atom Count29
Formal Charge0
Complexity477
SMILES
CCCCCCCCCCCCCCCCOC1=NC2=C(C=C(C=C2)C)C(=O)O1
InChI
InChI=1S/C25H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-25-26-23-18-17-21(2)20-22(23)24(27)29-25/h17-18,20H,3-16,19H2,1-2H3
InChIKey
MVCQKIKWYUURMU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cetilistat
CAS: 282526-98-1
CID: 9952916
Formula: C25H39NO3
MW: 401.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight401.6
XLogP39.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count16
Exact Mass401.29299411
Monoisotopic Mass401.29299411
Topological Polar Surface Area47.9 Ų
Heavy Atom Count29
Formal Charge0
Complexity477
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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