Products for Research Use Only

13-Hydroxy-9-octadecenoic acid

CAT: 0013-GTR19239261-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239261-01Size:50 mg
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Description
13-Hydroxy-9-octadecenoic acid is a hydroxy unsaturated fatty acid (HUFA) with documented anti-fungal properties. This small molecule is used in research to investigate lipid-mediated defense mechanisms in plant and microbial systems, both in vitro and in model organisms.
CAS Number
324575-43-1
Field of Research
Infectious Disease & Virology
Smiles
O=C (O) CCCCCCCC=CCCC (O) CCCCC
Molecular Formula
C18H34O3
Molecular Weight
298.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

13-Hydroxy-9-octadecenoic acid
CAS Number324575-43-1
PubChem CID22572147
IUPAC Name(E)-13-hydroxyoctadec-9-enoic acid
Molecular FormulaC18H34O3
Molecular Weight298.5
XLogP5.6
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Heavy Atom Count21
Formal Charge0
Complexity261
SMILES
CCCCCC(CC/C=C/CCCCCCCC(=O)O)O
InChI
InChI=1S/C18H34O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,17,19H,2-6,8,10-16H2,1H3,(H,20,21)/b9-7+
InChIKey
QVAVREIGSFJSOU-VQHVLOKHSA-N
Chemical Structure
2D Structure
2D structure of 13-Hydroxy-9-octadecenoic acid
CAS: 324575-43-1
CID: 22572147
Formula: C18H34O3
MW: 298.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.5
XLogP35.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Exact Mass298.25079494
Monoisotopic Mass298.25079494
Topological Polar Surface Area57.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity261
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes