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McN3716

CAT: 0931-T11978-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T11978-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
69207-52-9
Target
Mitochondrial Metabolism, CPT
Related Pathways
Metabolism
Purity
>99.99%
Bioactivity
McN3716 is a carnitine palmitoyltransferase I (CPT-1) inhibitor used for researching metabolic diseases.
Smiles
CCCCCCCCCCCCCCC1(CO1)C(=O)OC
Molecular Formula
C18H34O3
Molecular Weight
298.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methyl Palmoxirate

structure

CAS Number69207-52-9
PubChem CID68593
IUPAC Namemethyl 2-tetradecyloxirane-2-carboxylate
Molecular FormulaC18H34O3
Molecular Weight298.5
XLogP6.8
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Heavy Atom Count21
Formal Charge0
Complexity278
SMILES
CCCCCCCCCCCCCCC1(CO1)C(=O)OC
InChI
InChI=1S/C18H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(16-21-18)17(19)20-2/h3-16H2,1-2H3
InChIKey
RSSDZUNGAWCFPT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl Palmoxirate
CAS: 69207-52-9
CID: 68593
Formula: C18H34O3
MW: 298.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.5
XLogP36.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Exact Mass298.25079494
Monoisotopic Mass298.25079494
Topological Polar Surface Area38.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity278
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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