[2-[(E)-7-methoxy-7-oxidanylidene-hept-2-enyl]-4-oxidanyl-3-[(E)-3-oxidanyl-5-phenyl-pent-1-en-4-ynyl]cyclopentyl] 4-phenylbenzoate

Systemtic Name: [2-[(E)-7-methoxy-7-oxidanylidene-hept-2-enyl]-4-oxidanyl-3-[(E)-3-oxidanyl-5-phenyl-pent-1-en-4-ynyl]cyclopentyl] 4-phenylbenzoate Openeye Name: [4-hydroxy-3-[(E)-3-hydroxy-5-phenyl-pent-1-en-4-ynyl]-2-[(E)-7-methoxy-7-oxo-hept-2-enyl]cyclopentyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [4-hydroxy-3-[(E)-3-hydroxy-5-phenylpent-1-en-4-ynyl]-2-[(E)-7-methoxy-7-oxohept-2-enyl]cyclopentyl] ester IUPAC Name: [4-hydroxy-3-[(E)-3-hydroxy-5-phenylpent-1-en-4-ynyl]-2-[(E)-7-methoxy-7-oxohept-2-enyl]cyclopentyl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [4-hydroxy-3-[(E)-3-hydroxy-5-phenyl-pent-1-en-4-ynyl]-2-[(E)-7-keto-7-methoxy-hept-2-enyl]cyclopentyl] ester Formula: C37H38O6 MolecularWeight: 578.69402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC1C(CC(C1C=CC(C#CC2=CC=CC=C2)O)O)OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCC/C=C/CC1C(CC(C1/C=C/C(C#CC2=CC=CC=C2)O)O)OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C37H38O6/c1-42-36(40)17-11-3-2-10-16-33-32(25-24-31(38)23-18-27-12-6-4-7-13-27)34(39)26-35(33)43-37(41)30-21-19-29(20-22-30)28-14-8-5-9-15-28/h2,4-10,12-15,19-22,24-25,31-35,38-39H,3,11,16-17,26H2,1H3/b10-2+,25-24+