(5R,6Z,8Z,11Z)-5-oxidanyl-13-(2-pentylcyclopropen-1-yl)trideca-6,8,11-trienoate

Systemtic Name: (5R,6Z,8Z,11Z)-5-oxidanyl-13-(2-pentylcyclopropen-1-yl)trideca-6,8,11-trienoate Openeye Name: (5R,6Z,8Z,11Z)-5-hydroxy-13-(2-pentylcyclopropen-1-yl)trideca-6,8,11-trienoate CAS Name: (5R,6Z,8Z,11Z)-5-hydroxy-13-(2-pentyl-1-cyclopropenyl)trideca-6,8,11-trienoate IUPAC Name: (5R,6Z,8Z,11Z)-5-hydroxy-13-(2-pentylcyclopropen-1-yl)trideca-6,8,11-trienoate Traditional Name: (5R,6Z,8Z,11Z)-13-(2-amylcyclopropen-1-yl)-5-hydroxy-trideca-6,8,11-trienoate Formula: C21H31O3- MolecularWeight: 331.46904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C1)CC=CCC=CC=CC(CCCC(=O)[O-])O

Isomeric SMILES

CCCCCC1=C(C1)C/C=C\C/C=C\C=C/[C@@H](CCCC(=O)[O-])O

InChI

InChI=1S/C21H32O3/c1-2-3-8-12-18-17-19(18)13-9-6-4-5-7-10-14-20(22)15-11-16-21(23)24/h5-7,9-10,14,20,22H,2-4,8,11-13,15-17H2,1H3,(H,23,24)/p-1/b7-5-,9-6-,14-10-/t20-/m0/s1