(4S,5R)-5-(8-butoxy-6-oxidanyl-7-oxidanylidene-octyl)-4-[(E,3R)-3-methyldec-1-enyl]cyclopent-2-en-1-one

Systemtic Name: (4S,5R)-5-(8-butoxy-6-oxidanyl-7-oxidanylidene-octyl)-4-[(E,3R)-3-methyldec-1-enyl]cyclopent-2-en-1-one Openeye Name: (4S,5R)-5-(8-butoxy-6-hydroxy-7-oxo-octyl)-4-[(E,3R)-3-methyldec-1-enyl]cyclopent-2-en-1-one CAS Name: (4S,5R)-5-(8-butoxy-6-hydroxy-7-oxooctyl)-4-[(E,3R)-3-methyldec-1-enyl]-1-cyclopent-2-enone IUPAC Name: (4S,5R)-5-(8-butoxy-6-hydroxy-7-oxooctyl)-4-[(E,3R)-3-methyldec-1-enyl]cyclopent-2-en-1-one Traditional Name: (4S,5R)-5-(8-butoxy-6-hydroxy-7-keto-octyl)-4-[(E,3R)-3-methyldec-1-enyl]cyclopent-2-en-1-one Formula: C28H48O4 MolecularWeight: 448.67832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)C=CC1C=CC(=O)C1CCCCCC(C(=O)COCCCC)O

Isomeric SMILES

CCCCCCC[C@@H](C)/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCC(C(=O)COCCCC)O

InChI

InChI=1S/C28H48O4/c1-4-6-8-9-11-14-23(3)17-18-24-19-20-26(29)25(24)15-12-10-13-16-27(30)28(31)22-32-21-7-5-2/h17-20,23-25,27,30H,4-16,21-22H2,1-3H3/b18-17+/t23-,24+,25-,27?/m1/s1