(2E,5E,12E,15E)-1-oxidanylhenicosa-2,5,12,15-tetraen-4-one

Systemtic Name: (2E,5E,12E,15E)-1-oxidanylhenicosa-2,5,12,15-tetraen-4-one Openeye Name: (2E,5E,12E,15E)-1-hydroxyhenicosa-2,5,12,15-tetraen-4-one CAS Name: (2E,5E,12E,15E)-1-hydroxy-4-heneicosa-2,5,12,15-tetraenone IUPAC Name: (2E,5E,12E,15E)-1-hydroxyhenicosa-2,5,12,15-tetraen-4-one Traditional Name: (2E,5E,12E,15E)-1-hydroxyheneicosa-2,5,12,15-tetraen-4-one Formula: C21H34O2 MolecularWeight: 318.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCC=CC(=O)C=CCO

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCC/C=C/C(=O)/C=C/CO

InChI

InChI=1S/C21H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)19-17-20-22/h6-7,9-10,16-19,22H,2-5,8,11-15,20H2,1H3/b7-6+,10-9+,18-16+,19-17+