Structure Database (LMSD)
Common Name
15-(3-methyl-5-pentylfuran-2-yl)-pentadecanoic acid
Systematic Name
15-(5-pentyl-3-methylfuran-2-yl)-pentadecanoic acid
Synonyms
- 15M5
- 3-methyl-5-pentyl-2-furanpentadecanoic acid
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
ZXUFZNDRPGKIFV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C25H44O3/c1-3-4-15-18-23-21-22(2)24(28-23)19-16-13-11-9-7-5-6-8-10-12-14-17-20-25(26)27/h21H,3-20H2,1-2H3,(H,26,27)
SMILES (Click to copy)
C(CC)CCC1=CC(C)=C(CCCCCCCCCCCCCCC(=O)O)O1
References
Reference
Furan fatty acids – Beneficial or harmful to health?
Long Xua, Andrew J. Sinclair, Muniba Faiza, Daoming Li, Xianlin Han, Huiyong Yin,
Yonghua Wang. Progress in Lipid Research, Volume 68, October 2017, pp. 119-137.
https://www.sciencedirect.com/science/article/pii/S016378271730053X
Long Xua, Andrew J. Sinclair, Muniba Faiza, Daoming Li, Xianlin Han, Huiyong Yin,
Yonghua Wang. Progress in Lipid Research, Volume 68, October 2017, pp. 119-137.
https://www.sciencedirect.com/science/article/pii/S016378271730053X
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Procambarus clarkii
(#6728)
Malacostraca
(#6681)
Furan fatty acids - Beneficial or harmful to health?,
Prog Lipid Res, 2017
Prog Lipid Res, 2017
Pubmed ID:
29051014
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
28
Rings
1
Aromatic Rings
1
Rotatable Bonds
19
Van der Waals Molecular Volume
436.25
Topological Polar Surface Area
50.44
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
logP
8.02
Molar Refractivity
118.03
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Updated at
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