2-[(3E)-5,6,7-trimethylidenehentriaconta-1,3-dien-2-yl]butanedioic acid

Systemtic Name: 2-[(3E)-5,6,7-trimethylidenehentriaconta-1,3-dien-2-yl]butanedioic acid Openeye Name: 2-[(E)-1,4,5,6-tetramethylenetriacont-2-enyl]butanedioic acid CAS Name: 2-[(3E)-5,6,7-trimethylenehentriaconta-1,3-dien-2-yl]butanedioic acid IUPAC Name: 2-[(3E)-5,6,7-trimethylidenehentriaconta-1,3-dien-2-yl]butanedioic acid Traditional Name: 2-[(2E)-6-lignoceryl-1,4,5-trimethylene-hepta-2,6-dienyl]succinic acid Formula: C38H64O4 MolecularWeight: 584.91236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(=C)C(=C)C(=C)C=CC(=C)C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(=C)C(=C)C(=C)/C=C/C(=C)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C38H64O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-32(2)35(5)33(3)29-30-34(4)36(38(41)42)31-37(39)40/h29-30,36H,2-28,31H2,1H3,(H,39,40)(H,41,42)/b30-29+