Structure Database (LMSD)
Common Name
Isoheptadecanoic acid
Systematic Name
15-methyl-hexadecanoic acid
Synonyms
- 15-methyl palmitic acid
- Isomargaric acid
- Subtiloheptadecanoic acid
- Methylpalmitic acid
No other lipid differing only in stereochemistry/bond geometry found
3D model of Isoheptadecanoic 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)
IIUXHTGBZYEGHI-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H34O2/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17(18)19/h16H,3-15H2,1-2H3,(H,18,19)
SMILES (Click to copy)
C(CCCCC(C)C)CCCCCCCCC(=O)O
Other Databases
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0237
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
Calculated Physicochemical Properties
Heavy Atoms
19
Rings
0
Aromatic Rings
0
Rotatable Bonds
14
Van der Waals Molecular Volume
317.60
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
5.80
Molar Refractivity
82.49
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Created at
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Updated at
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