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Linoleyl oleate

CAT: 0804-HY-165955Size: 1 EachDry Ice: NoHazardous: No
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Description
Linoleyl oleate is an ester product.
CAS Number
17673-58-4
UNSPSC
12352211
Target
Biochemical Assay Reagents
Type
Natural Products
Related Pathways
Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/linoleyl-oleate.html
Smiles
CCCCCCCC/C=C\CCCCCCCC(OCCCCCCCC/C=C\C/C=C\CCCCC)=O
Molecular Formula
C36H66O2
Molecular Weight
530.91
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Linoleyl oleate

Linoleyl oleate is a wax ester.

CAS Number17673-58-4
PubChem CID45934108
IUPAC Name[(9Z,12Z)-octadeca-9,12-dienyl] (Z)-octadec-9-enoate
Molecular FormulaC36H66O2
Molecular Weight530.9
XLogP14.8
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count31
Heavy Atom Count38
Formal Charge0
Complexity546
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OCCCCCCCC/C=C\C/C=C\CCCCC
InChI
InChI=1S/C36H66O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17-20H,3-10,12,14-16,21-35H2,1-2H3/b13-11-,19-17-,20-18-
InChIKey
UHMXMURYWVGQFV-LTEAFHAISA-N
Chemical Structure
2D Structure
2D structure of Linoleyl oleate
CAS: 17673-58-4
CID: 45934108
Formula: C36H66O2
MW: 530.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight530.9
XLogP314.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count31
Exact Mass530.50628134
Monoisotopic Mass530.50628134
Topological Polar Surface Area26.3 Ų
Heavy Atom Count38
Formal Charge0
Complexity546
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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