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18-Hydroxyoctadecanoic acid

CAT: 0804-HY-W105739-02Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W105739-02Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
18-Hydroxyoctadecanoic acid (Octadecanoic acid, 18-hydroxy) is an ester product.
CAS Number
3155-42-8
Product Name Alternative
Octadecanoic acid, 18-hydroxy
UNSPSC
12352211
Hazard Statement
H302, H315, H319, H335
Target
Others
Type
Natural Products
Related Pathways
Others
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/18-hydroxyoctadecanoic-acid.html
Purity
98.0
Smiles
C(CCCCCCCCC(=O)O)CCCCCCCCO
Molecular Formula
C18H36O3
Molecular Weight
300.48
Precautions
H302, H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

18-Hydroxyoctadecanoic acid

18-hydroxyoctadecanoic acid is an -hydroxy-long-chain fatty acid that is octadecanoic (stearic) acid in which one of the hydrogens of the terminal methyl group has been replaced by a hydroxy group. It has a role as an apoptosis inducer. It is an omega-hydroxy-long-chain fatty acid and a hydroxyoctadecanoic acid. It is a conjugate acid of a 18-hydroxyoctadecanoate.

CAS Number3155-42-8
PubChem CID5282915
IUPAC Name18-hydroxyoctadecanoic acid
Molecular FormulaC18H36O3
Molecular Weight300.5
XLogP5.3
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Heavy Atom Count21
Formal Charge0
Complexity217
SMILES
C(CCCCCCCCC(=O)O)CCCCCCCCO
InChI
InChI=1S/C18H36O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h19H,1-17H2,(H,20,21)
InChIKey
VLHZUYUOEGBBJB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 18-Hydroxyoctadecanoic acid
CAS: 3155-42-8
CID: 5282915
Formula: C18H36O3
MW: 300.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.5
XLogP35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Exact Mass300.26644501
Monoisotopic Mass300.26644501
Topological Polar Surface Area57.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity217
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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