Structure Database (LMSD)
Common Name
3-hydroxy-decanoic acid
Systematic Name
3-hydroxy-decanoic acid
Synonyms
3D model of 3-hydroxy-decanoic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Biological Context
3-hydroxy Decanoic acid is a hydroxy fatty acid and the predominant monomer in methyl-branched poly(3-hydroxyalkanoate) (PHA) polymers produced by P. putida CA-3.1 It is present in LPS from the H. pylori strain SS1 and in the lipid A component of clinical isolates of P. aeruginosa isolated from patients with cystic fibrosis but not the environment or patients with other conditions.2,3 3-hydroxy Decanoic acid inhibits mitotic progression of O. virens pollens via impairment of plasma membrane function.4 It also induces a reversible shape change of the membrane crenation in human erythrocytes. [Matreya, LLC. Catalog No. 1727]
This information has been provided by Cayman Chemical
References
4. Kanaho, Y., Sato, T., Fuji, T., et al. Shape-transforming action of myrmicacin (3-hydroxydecanoic acid) and some related compounds on the membrane of intact human erythrocytes. Chem. Pharm. Bull. (Tokyo) 29(10), 3063-3066 (1981).
String Representations
InChiKey (Click to copy)
FYSSBMZUBSBFJL-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H20O3/c1-2-3-4-5-6-7-9(11)8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)
SMILES (Click to copy)
C(CC(O)CCCCCCC)(=O)O
Other Databases
LIPIDAT ID
1799
HMDB ID
CHEBI ID
PubChem CID
Cayman ID
GuidePharm ID
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
205.29
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
2.47
Molar Refractivity
52.15
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Updated at
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