(13E,16E)-2-ethyl-5-(oxan-2-yloxy)-3-oxidanyl-docosa-13,16-dienoic acid

Systemtic Name: (13E,16E)-2-ethyl-5-(oxan-2-yloxy)-3-oxidanyl-docosa-13,16-dienoic acid Openeye Name: (13E,16E)-2-ethyl-3-hydroxy-5-tetrahydropyran-2-yloxy-docosa-13,16-dienoic acid CAS Name: (13E,16E)-2-ethyl-3-hydroxy-5-(2-oxanyloxy)docosa-13,16-dienoic acid IUPAC Name: (13E,16E)-2-ethyl-3-hydroxy-5-(oxan-2-yloxy)docosa-13,16-dienoic acid Traditional Name: (13E,16E)-2-ethyl-3-hydroxy-5-tetrahydropyran-2-yloxy-docosa-13,16-dienoic acid Formula: C29H52O5 MolecularWeight: 480.72018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(CC(C(CC)C(=O)O)O)OC1CCCCO1

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(CC(C(CC)C(=O)O)O)OC1CCCCO1

InChI

InChI=1S/C29H52O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25(34-28-22-19-20-23-33-28)24-27(30)26(4-2)29(31)32/h8-9,11-12,25-28,30H,3-7,10,13-24H2,1-2H3,(H,31,32)/b9-8+,12-11+