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Linolenic Acid Ethyl Ester

CAT: 0572-TRC-L467645-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-L467645-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1191-41-9
Synonyms
(Z,Z,Z)-9,12,15-Octadecatrienoic acid ethyl ester; Ethyl linolenate
Hazard Statement
No Data Available
Purity
>95% (GC)
Smiles
CCOC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC
Molecular Formula
C20 H34 O2
Molecular Weight
306.48
InChI
InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
Additionnal Information
IUPAC name: ethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Ethyl linolenate

Ethyl linolenate is a long-chain fatty acid ethyl ester resulting from the formal condensation of the carboxy group of linolenic acid with the hydroxy group of ethanol. It has a role as a plant metabolite and a human metabolite. It is functionally related to an alpha-linolenic acid.

CAS Number1191-41-9
PubChem CID5367460
IUPAC Nameethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
Molecular FormulaC20H34O2
Molecular Weight306.5
XLogP6.6
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count15
Heavy Atom Count22
Formal Charge0
Complexity327
SMILES
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC
InChI
InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
InChIKey
JYYFMIOPGOFNPK-AGRJPVHOSA-N
Chemical Structure
2D Structure
2D structure of Ethyl linolenate
CAS: 1191-41-9
CID: 5367460
Formula: C20H34O2
MW: 306.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.5
XLogP36.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count15
Exact Mass306.255880323
Monoisotopic Mass306.255880323
Topological Polar Surface Area26.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity327
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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Alternative Products

CatalogName
sc-487989γ-Linolenic Acid Ethyl Ester
sc-204794ALinolenic Acid ethyl ester
HY-W744842γ-Linolenic acid ethyl ester-d5
453774-01Linolenic Acid Ethyl Ester-d5
sc-487986Linolenic Acid Ethyl Ester- 13C18
TBW01460gamma-LINOLENIC ACID ETHYL ESTER
T84643-01Dihomo-γ-Linolenic Acid ethyl ester
AR-P32115-01Î3-Linolenic Acid Ethyl Ester
281390-01Linolenic acid ethyl ester discontinued. See 453773

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