(E)-7-[5-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-4-oxidanyl-cyclopenten-1-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[5-[(E)-3-methyl-3-oxidanyl-oct-1-enyl]-4-oxidanyl-cyclopenten-1-yl]hept-5-enoic acid Openeye Name: (E)-7-[4-hydroxy-5-[(E)-3-hydroxy-3-methyl-oct-1-enyl]cyclopenten-1-yl]hept-5-enoic acid CAS Name: (E)-7-[4-hydroxy-5-[(E)-3-hydroxy-3-methyloct-1-enyl]-1-cyclopentenyl]-5-heptenoic acid IUPAC Name: (E)-7-[4-hydroxy-5-[(E)-3-hydroxy-3-methyloct-1-enyl]cyclopenten-1-yl]hept-5-enoic acid Traditional Name: (E)-7-[4-hydroxy-5-[(E)-3-hydroxy-3-methyl-oct-1-enyl]cyclopenten-1-yl]hept-5-enoic acid Formula: C21H34O4 MolecularWeight: 350.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C=CC1C(CC=C1CC=CCCCC(=O)O)O)O

Isomeric SMILES

CCCCCC(C)(/C=C/C1C(CC=C1C/C=C/CCCC(=O)O)O)O

InChI

InChI=1S/C21H34O4/c1-3-4-9-15-21(2,25)16-14-18-17(12-13-19(18)22)10-7-5-6-8-11-20(23)24/h5,7,12,14,16,18-19,22,25H,3-4,6,8-11,13,15H2,1-2H3,(H,23,24)/b7-5+,16-14+