Structure Database (LMSD)
Common Name
Sabinic acid
Systematic Name
12-hydroxy-dodecanoic acid
Synonyms
- 12-hydroxy lauric acid
3D model of Sabinic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
ZDHCZVWCTKTBRY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)
SMILES (Click to copy)
C(CCCCCCCCCO)CC(=O)O
References
Other Databases
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0305
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
PDB ID
GuidePharm ID
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
11
Van der Waals Molecular Volume
239.89
Topological Polar Surface Area
57.53
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
3.25
Molar Refractivity
61.38
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Created at
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Updated at
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