(9E,36E)-23-ethyl-23-oxidanyl-pentatetraconta-9,36-diene-22,24-dione

Systemtic Name: (9E,36E)-23-ethyl-23-oxidanyl-pentatetraconta-9,36-diene-22,24-dione Openeye Name: (9E,36E)-23-ethyl-23-hydroxy-pentatetraconta-9,36-diene-22,24-dione CAS Name: (9E,36E)-23-ethyl-23-hydroxypentatetraconta-9,36-diene-22,24-dione IUPAC Name: (9E,36E)-23-ethyl-23-hydroxypentatetraconta-9,36-diene-22,24-dione Traditional Name: (9E,36E)-23-ethyl-23-hydroxy-pentatetraconta-9,36-diene-22,24-dione Formula: C47H88O3 MolecularWeight: 701.19982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCC(=O)C(CC)(C(=O)CCCCCCCCCCCC=CCCCCCCCC)O

Isomeric SMILES

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

InChI

InChI=1S/C47H88O3/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45(48)47(50,6-3)46(49)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h19-22,50H,4-18,23-44H2,1-3H3/b21-19+,22-20+