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methyl (5E,8E,11E)-14,15-bis(oxidanyl)icosa-5,8,11-trienoate

methyl (5E,8E,11E)-14,15-bis(oxidanyl)icosa-5,8,11-trienoate

Systemtic Name:methyl (5E,8E,11E)-14,15-bis(oxidanyl)icosa-5,8,11-trienoate
Openeye Name:methyl (5E,8E,11E)-14,15-dihydroxyicosa-5,8,11-trienoate
CAS Name:(5E,8E,11E)-14,15-dihydroxyeicosa-5,8,11-trienoic acid methyl ester
IUPAC Name:methyl (5E,8E,11E)-14,15-dihydroxyicosa-5,8,11-trienoate
Traditional Name:(5E,8E,11E)-14,15-dihydroxyeicosa-5,8,11-trienoic acid methyl ester
Formula: C21H36O4
MolecularWeight: 352.50814
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CC=CCC=CCC=CCCCC(=O)OC)O)O


Isomeric SMILES

CCCCCC(C(C/C=C/C/C=C/C/C=C/CCCC(=O)OC)O)O


InChI

InChI=1S/C21H36O4/c1-3-4-13-16-19(22)20(23)17-14-11-9-7-5-6-8-10-12-15-18-21(24)25-2/h5,7-8,10-11,14,19-20,22-23H,3-4,6,9,12-13,15-18H2,1-2H3/b7-5+,10-8+,14-11+


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