Structure Database (LMSD)
Common Name
Heptylic acid
Systematic Name
heptanoic acid
Synonyms
- Enanthic acid
- Enanthylic acid
- Heptoic acid
- C7:0
- Enanthoic acid
- Oenanthic acid
3D model of Heptylic 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
Reactions
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Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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String Representations
InChiKey (Click to copy)
MNWFXJYAOYHMED-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)
SMILES (Click to copy)
CCCCCCC(=O)O
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0007
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
PDB ID
Calculated Physicochemical Properties
Heavy Atoms
9
Rings
0
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
144.60
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
2.04
Molar Refractivity
36.39
Admin
Created at
-
Updated at
25th Apr 2022