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ETC-1002

CAT: 0607-A8710-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-A8710-5Size:5 mg
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Description
ACL inhibitor and AMPK activator
CAS Number
738606-46-7
Product Name Alternative
8-hydroxy-2,2,14,14-tetramethylpentadecanedioic acid
Field of Research
Others ATP citrate lyase
Purity
0.98
Solubility
insoluble in H2O; ≥97.6 mg/mL in DMSO; ≥42.5 mg/mL in EtOH
Smiles
OC(C(C)(C)CCCCCC(O)CCCCCC(C)(C)C(O)=O)=O
Molecular Formula
C19H36O5
Molecular Weight
344.49
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Bempedoic Acid

Bempedoic acid is an alpha,-dicarboxylic acid that is pentadecanedioic acid which is substituted by methyl groups groups at positions 2 and 14, and by a hydroxy group at position 8. It is a drug used for the treatment of high LDL cholesterol, which is sometimes referred to as 'bad cholesterol'. It has a role as an EC 2.3.3.8 (ATP citrate synthase) inhibitor, an antilipemic drug and a prodrug.

CAS Number738606-46-7
PubChem CID10472693
IUPAC Name8-hydroxy-2,2,14,14-tetramethylpentadecanedioic acid
Molecular FormulaC19H36O5
Molecular Weight344.5
XLogP4.8
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Heavy Atom Count24
Formal Charge0
Complexity351
SMILES
CC(C)(CCCCCC(CCCCCC(C)(C)C(=O)O)O)C(=O)O
InChI
InChI=1S/C19H36O5/c1-18(2,16(21)22)13-9-5-7-11-15(20)12-8-6-10-14-19(3,4)17(23)24/h15,20H,5-14H2,1-4H3,(H,21,22)(H,23,24)
InChIKey
HYHMLYSLQUKXKP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bempedoic Acid
CAS: 738606-46-7
CID: 10472693
Formula: C19H36O5
MW: 344.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.5
XLogP34.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass344.25627424
Monoisotopic Mass344.25627424
Topological Polar Surface Area94.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity351
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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