N-[(4E,8E)-9-methyl-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]-2-oxidanyl-octadecanamide

Systemtic Name: N-[(4E,8E)-9-methyl-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]-2-oxidanyl-octadecanamide Openeye Name: 2-hydroxy-N-[(3E,7E)-2-hydroxy-1-(hydroxymethyl)-8-methyl-heptadeca-3,7-dienyl]octadecanamide CAS Name: N-[(4E,8E)-1,3-dihydroxy-9-methyloctadeca-4,8-dien-2-yl]-2-hydroxyoctadecanamide IUPAC Name: N-[(4E,8E)-1,3-dihydroxy-9-methyloctadeca-4,8-dien-2-yl]-2-hydroxyoctadecanamide Traditional Name: 2-hydroxy-N-[(3E,7E)-2-hydroxy-8-methyl-1-methylol-heptadeca-3,7-dienyl]stearamide Formula: C37H71NO4 MolecularWeight: 593.96394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)NC(CO)C(C=CCCC=C(C)CCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)NC(CO)C(/C=C/CC/C=C(\C)/CCCCCCCCC)O)O

InChI

InChI=1S/C37H71NO4/c1-4-6-8-10-12-13-14-15-16-17-18-20-22-26-31-36(41)37(42)38-34(32-39)35(40)30-27-23-25-29-33(3)28-24-21-19-11-9-7-5-2/h27,29-30,34-36,39-41H,4-26,28,31-32H2,1-3H3,(H,38,42)/b30-27+,33-29+