Structure Database (LMSD)
Common Name
Isopentadecylic acid
Systematic Name
13-methyl-tetradecanoic acid
Synonyms
- 13-methylmyristic acid
- Isopentadecanoic acid
- Subtilopentadecanoic acid
3D model of Isopentadecylic 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
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Ovis aries
(#9940)
Mammalia
(#40674)
The branched-chain fatty acids of mutton fat. II. The isolation of (+)-12-methyltetradecanoic acid and the 13-methyltetradecanoic acid.,
Biochem J, 1953
Biochem J, 1953
Pubmed ID:
13032080
DOI:
10.1042/bj0530374
Myxococcus xanthus
(#34)
Myxococcia
(#32015)
Fatty acids of Myxococcus xanthus.,
J Bacteriol, 1973
J Bacteriol, 1973
Pubmed ID:
4197903
String Representations
InChiKey (Click to copy)
ZOCYQVNGROEVLU-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C15H30O2/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15(16)17/h14H,3-13H2,1-2H3,(H,16,17)
SMILES (Click to copy)
C(CCC(C)C)CCCCCCCCC(=O)O
Other Databases
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0234
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
Calculated Physicochemical Properties
Heavy Atoms
17
Rings
0
Aromatic Rings
0
Rotatable Bonds
12
Van der Waals Molecular Volume
283.00
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.02
Molar Refractivity
73.26
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