(8E,11R,12E,14E)-15-bromanyl-9-methyl-11-oxidanyl-7-oxidanylidene-pentadeca-8,12,14-trienoic acid

Systemtic Name: (8E,11R,12E,14E)-15-bromanyl-9-methyl-11-oxidanyl-7-oxidanylidene-pentadeca-8,12,14-trienoic acid Openeye Name: (8E,11R,12E,14E)-15-bromo-11-hydroxy-9-methyl-7-oxo-pentadeca-8,12,14-trienoic acid CAS Name: (8E,11R,12E,14E)-15-bromo-11-hydroxy-9-methyl-7-oxopentadeca-8,12,14-trienoic acid IUPAC Name: (8E,11R,12E,14E)-15-bromo-11-hydroxy-9-methyl-7-oxopentadeca-8,12,14-trienoic acid Traditional Name: (8E,11R,12E,14E)-15-bromo-11-hydroxy-7-keto-9-methyl-pentadeca-8,12,14-trienoic acid Formula: C16H23BrO4 MolecularWeight: 359.25542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)CCCCCC(=O)O)CC(C=CC=CBr)O

Isomeric SMILES

C/C(=C\C(=O)CCCCCC(=O)O)/C[C@H](/C=C/C=C/Br)O

InChI

InChI=1S/C16H23BrO4/c1-13(12-15(19)8-5-6-10-17)11-14(18)7-3-2-4-9-16(20)21/h5-6,8,10-11,15,19H,2-4,7,9,12H2,1H3,(H,20,21)/b8-5+,10-6+,13-11+/t15-/m0/s1