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methanolate; methyl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate

methanolate; methyl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate

Systemtic Name:methanolate; methyl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate
Openeye Name:methanolate; methyl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate
CAS Name:(5E,8E,11E,14E)-eicosa-5,8,11,14-tetraenoic acid methyl ester; methanolate
IUPAC Name:methanolate; methyl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate
Traditional Name:(5E,8E,11E,14E)-eicosa-5,8,11,14-tetraenoic acid methyl ester; methanolate
Formula: C22H37O3-
MolecularWeight: 349.52738
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC.C[O-]


Isomeric SMILES

CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCCC(=O)OC.C[O-]


InChI

InChI=1S/C21H34O2.CH3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2;1-2/h7-8,10-11,13-14,16-17H,3-6,9,12,15,18-20H2,1-2H3;1H3/q;-1/b8-7+,11-10+,14-13+,17-16+;


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