3-[5-(5-oxidanylidenepent-4-enyl)-2-[(E)-7-oxidanylpentadec-5-enoxy]phenyl]propanoic acid

Systemtic Name: 3-[5-(5-oxidanylidenepent-4-enyl)-2-[(E)-7-oxidanylpentadec-5-enoxy]phenyl]propanoic acid Openeye Name: 3-[2-[(E)-7-hydroxypentadec-5-enoxy]-5-(5-oxopent-4-enyl)phenyl]propanoic acid CAS Name: 3-[2-[(E)-7-hydroxypentadec-5-enoxy]-5-(5-oxopent-4-enyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(E)-7-hydroxypentadec-5-enoxy]-5-(5-oxopent-4-enyl)phenyl]propanoic acid Traditional Name: 3-[2-[(E)-7-hydroxypentadec-5-enoxy]-5-(5-ketopent-4-enyl)phenyl]propionic acid Formula: C29H44O5 MolecularWeight: 472.65666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=CCCCCOC1=C(C=C(C=C1)CCCC=C=O)CCC(=O)O)O

Isomeric SMILES

CCCCCCCCC(/C=C/CCCCOC1=C(C=C(C=C1)CCCC=C=O)CCC(=O)O)O

InChI

InChI=1S/C29H44O5/c1-2-3-4-5-6-11-16-27(31)17-12-7-8-14-23-34-28-20-18-25(15-10-9-13-22-30)24-26(28)19-21-29(32)33/h12-13,17-18,20,24,27,31H,2-11,14-16,19,21,23H2,1H3,(H,32,33)/b17-12+