(E,12R,15S)-12,15-bis(oxidanyl)docos-13-enoic acid

Systemtic Name: (E,12R,15S)-12,15-bis(oxidanyl)docos-13-enoic acid Openeye Name: (E,12R,15S)-12,15-dihydroxydocos-13-enoic acid CAS Name: (E,12R,15S)-12,15-dihydroxy-13-docosenoic acid IUPAC Name: (E,12R,15S)-12,15-dihydroxydocos-13-enoic acid Traditional Name: (E,12R,15S)-12,15-dihydroxydocos-13-enoic acid Formula: C22H42O4 MolecularWeight: 370.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C=CC(CCCCCCCCCCC(=O)O)O)O

Isomeric SMILES

CCCCCCC[C@@H](/C=C/[C@@H](CCCCCCCCCCC(=O)O)O)O

InChI

InChI=1S/C22H42O4/c1-2-3-4-9-12-15-20(23)18-19-21(24)16-13-10-7-5-6-8-11-14-17-22(25)26/h18-21,23-24H,2-17H2,1H3,(H,25,26)/b19-18+/t20-,21+/m0/s1