Structure Database (LMSD)
Common Name
Azelaic acid
Systematic Name
Nonanedioic acid
Synonyms
3D model of Azelaic 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
String Representations
InChiKey (Click to copy)
BDJRBEYXGGNYIS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)
SMILES (Click to copy)
C(CCCCCCCC(=O)O)(=O)O
Other Databases
Wikipedia
LIPIDAT ID
1819
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
PlantFA ID
Cayman ID
PDB ID
GuidePharm ID
Calculated Physicochemical Properties
Heavy Atoms
13
Rings
0
Aromatic Rings
0
Rotatable Bonds
8
Van der Waals Molecular Volume
194.14
Topological Polar Surface Area
74.60
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
logP
1.89
Molar Refractivity
47.59
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Created at
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Updated at
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