Structure Database (LMSD)
Common Name
Clupadonic acid
Systematic Name
Z,8Z,12Z,15Z,19Z-docosapentaenoic acid
Synonyms
- (4Z,8Z,12Z,15Z,19Z)-docosa-4,8,12,15,19-pentaenoic acid
3D model of Clupadonic 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)
PIFPCDRPHCQLSJ-SBFJRTJOSA-N
InChi (Click to copy)
InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,7-8,10-11,14-15,18-19H,2,5-6,9,12-13,16-17,20-21H2,1H3,(H,23,24)/b4-3-,8-7-,11-10-,15-14-,19-18-
SMILES (Click to copy)
C(CC/C=C\CC/C=C\CC/C=C\C/C=C\CC/C=C\CC)(=O)O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
24
Rings
0
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
390.9
Topological Polar Surface Area
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
6.77
Molar Refractivity
105.18
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Created at
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Updated at
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