Structure Database (LMSD)
Common Name
Nuciferoic Acid
Systematic Name
11-oxo-14-nonacosenoic acid
Synonyms
- Nuciferoate
3D model of Nuciferoic 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)
BSDRFFLTAKTFLT-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C29H54O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-25-28(30)26-23-20-17-15-18-21-24-27-29(31)32/h16,19H,2-15,17-18,20-27H2,1H3,(H,31,32)
SMILES (Click to copy)
C(CCCCCCCCCC(=O)CCC=CCCCCCCCCCCCCCC)(=O)O
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Cocos nucifera
(#13894)
Magnoliopsida
(#3398)
Isolation and Characterization of Nuciferoic Acid, a Novel Keto Fatty Acid with Hyaluronidase Inhibitory Activity from Cocos nucifera Linn. Endocarp.,
Curr Top Med Chem, 2018
Curr Top Med Chem, 2018
Pubmed ID:
30582479
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
32
Rings
0
Aromatic Rings
0
Rotatable Bonds
26
Van der Waals Molecular Volume
528.71
Topological Polar Surface Area
54.37
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
logP
9.58
Molar Refractivity
138.26
Admin
Created at
12th Mar 2020
Updated at
20th Feb 2024