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- ChemComp-LNL: ALPHA-LINOLENIC ACID -

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Basic information

EntryDatabase: PDB chemical components / ID: LNL
NameName: alpha-linolenic acid

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Chemical information

Composition
Formula: C18H30O2 / Number of atoms: 50 / Formula weight: 278.43 / Formal charge: 0
Others

1fk6

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: LNL / Model coordinates PDB-ID: 1FK6
History
Create componentAug 23, 2000
Modify descriptorJun 4, 2011
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=C(O)CCCCCCC\C=C/C\C=C/C\C=C/CC
CACTVS 3.341CCC=CCC=CCC=CCCCCCCCC(O)=O
OpenEye OEToolkits 1.5.0CCC=CCC=CCC=CCCCCCCCC(=O)O

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SMILES CANONICAL

CACTVS 3.341CC\C=C/C/C=C\C\C=C/CCCCCCCC(O)=O
OpenEye OEToolkits 1.5.0CCC=CCC=CC\C=C/CCCCCCCC(=O)O

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InChI

InChI 1.03InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-

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InChIKey

InChI 1.03DTOSIQBPPRVQHS-PDBXOOCHSA-N

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SYSTEMATIC NAME

ACDLabs 10.04(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid
OpenEye OEToolkits 1.5.0(9Z)-octadeca-9,12,15-trienoic acid

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PDB entries

Showing all 6 items

PDB-1fk6:
STRUCTURAL BASIS OF NON-SPECIFIC LIPID BINDING IN MAIZE LIPID-TRANSFER PROTEIN COMPLEXES WITH ALPHA-LINOLENIC ACID REVEALED BY HIGH-RESOLUTION X-RAY CRYSTALLOGRAPHY

PDB-2byo:
Crystal structure of Mycobacterium tuberculosis lipoprotein LppX (Rv2945c)

PDB-4e1g:
X-ray crystal structure of alpha-linolenic acid bound to the cyclooxygenase channel of cyclooxygenase-2

PDB-7ffx:
The 0.88 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with alpha-llinolenic acid

PDB-8c29:
Cryo-EM structure of photosystem II C2S2 supercomplex from Norway spruce (Picea abies) at 2.8 Angstrom resolution

PDB-9hd7:
Cryo-EM structure of photosystem II C2S2M2L2 supercomplex from the green alga Chlorella ohadii

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