6-[(1R,2R)-3-methoxy-2-[(E)-3-methoxy-4-phenylsulfanyl-but-1-enyl]-5-oxidanylidene-cyclopentyl]hexyl-methyl-phosphinic acid

Systemtic Name: 6-[(1R,2R)-3-methoxy-2-[(E)-3-methoxy-4-phenylsulfanyl-but-1-enyl]-5-oxidanylidene-cyclopentyl]hexyl-methyl-phosphinic acid Openeye Name: 6-[(1R,2R)-3-methoxy-2-[(E)-3-methoxy-4-phenylsulfanyl-but-1-enyl]-5-oxo-cyclopentyl]hexyl-methyl-phosphinic acid CAS Name: 6-[(1R,2R)-3-methoxy-2-[(E)-3-methoxy-4-(phenylthio)but-1-enyl]-5-oxocyclopentyl]hexyl-methylphosphinic acid IUPAC Name: 6-[(1R,2R)-3-methoxy-2-[(E)-3-methoxy-4-phenylsulfanylbut-1-enyl]-5-oxocyclopentyl]hexyl-methylphosphinic acid Traditional Name: 6-[(1R,2R)-5-keto-3-methoxy-2-[(E)-3-methoxy-4-(phenylthio)but-1-enyl]cyclopentyl]hexyl-methyl-phosphinic acid Formula: C24H37O5PS MolecularWeight: 468.586341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CC(=O)C(C1C=CC(CSC2=CC=CC=C2)OC)CCCCCCP(=O)(C)O

Isomeric SMILES

COC1CC(=O)[C@@H]([C@H]1/C=C/C(CSC2=CC=CC=C2)OC)CCCCCCP(=O)(C)O

InChI

InChI=1S/C24H37O5PS/c1-28-19(18-31-20-11-7-6-8-12-20)14-15-22-21(23(25)17-24(22)29-2)13-9-4-5-10-16-30(3,26)27/h6-8,11-12,14-15,19,21-22,24H,4-5,9-10,13,16-18H2,1-3H3,(H,26,27)/b15-14+/t19?,21-,22-,24?/m1/s1