3-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanyl-2-[4-(3-oxidanyl-2-oxidanylidene-propoxy)but-2-ynyl]cyclopentan-1-one

Systemtic Name: 3-[(E)-4-methyl-4-oxidanyl-oct-1-enyl]-4-oxidanyl-2-[4-(3-oxidanyl-2-oxidanylidene-propoxy)but-2-ynyl]cyclopentan-1-one Openeye Name: 4-hydroxy-3-[(E)-4-hydroxy-4-methyl-oct-1-enyl]-2-[4-(3-hydroxy-2-oxo-propoxy)but-2-ynyl]cyclopentanone CAS Name: 4-hydroxy-3-[(E)-4-hydroxy-4-methyloct-1-enyl]-2-[4-(3-hydroxy-2-oxopropoxy)but-2-ynyl]-1-cyclopentanone IUPAC Name: 4-hydroxy-3-[(E)-4-hydroxy-4-methyloct-1-enyl]-2-[4-(3-hydroxy-2-oxopropoxy)but-2-ynyl]cyclopentan-1-one Traditional Name: 4-hydroxy-2-[4-(3-hydroxy-2-keto-propoxy)but-2-ynyl]-3-[(E)-4-hydroxy-4-methyl-oct-1-enyl]cyclopentanone Formula: C21H32O6 MolecularWeight: 380.47518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC=CC1C(CC(=O)C1CC#CCOCC(=O)CO)O)O

Isomeric SMILES

CCCCC(C)(C/C=C/C1C(CC(=O)C1CC#CCOCC(=O)CO)O)O

InChI

InChI=1S/C21H32O6/c1-3-4-10-21(2,26)11-7-9-18-17(19(24)13-20(18)25)8-5-6-12-27-15-16(23)14-22/h7,9,17-18,20,22,25-26H,3-4,8,10-15H2,1-2H3/b9-7+