methyl 7-[5-[(E)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-3-(6-methoxy-6-oxidanylidene-hexyl)sulfanyl-2-oxidanylidene-cyclopent-3-en-1-yl]-7-oxidanyl-hept-5-ynoate

Systemtic Name: methyl 7-[5-[(E)-3-cyclopentyl-3-oxidanyl-prop-1-enyl]-3-(6-methoxy-6-oxidanylidene-hexyl)sulfanyl-2-oxidanylidene-cyclopent-3-en-1-yl]-7-oxidanyl-hept-5-ynoate Openeye Name: methyl 7-[5-[(E)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-3-(6-methoxy-6-oxo-hexyl)sulfanyl-2-oxo-cyclopent-3-en-1-yl]-7-hydroxy-hept-5-ynoate CAS Name: 7-[5-[(E)-3-cyclopentyl-3-hydroxyprop-1-enyl]-3-[(6-methoxy-6-oxohexyl)thio]-2-oxo-1-cyclopent-3-enyl]-7-hydroxy-5-heptynoic acid methyl ester IUPAC Name: methyl 7-[5-[(E)-3-cyclopentyl-3-hydroxyprop-1-enyl]-3-(6-methoxy-6-oxohexyl)sulfanyl-2-oxocyclopent-3-en-1-yl]-7-hydroxyhept-5-ynoate Traditional Name: 7-[5-[(E)-3-cyclopentyl-3-hydroxy-prop-1-enyl]-2-keto-3-[(6-keto-6-methoxy-hexyl)thio]cyclopent-3-en-1-yl]-7-hydroxy-hept-5-ynoic acid methyl ester Formula: C28H40O7S MolecularWeight: 520.678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCSC1=CC(C(C1=O)C(C#CCCCC(=O)OC)O)C=CC(C2CCCC2)O

Isomeric SMILES

COC(=O)CCCCCSC1=CC(C(C1=O)C(C#CCCCC(=O)OC)O)/C=C/C(C2CCCC2)O

InChI

InChI=1S/C28H40O7S/c1-34-25(31)14-6-3-5-13-23(30)27-21(16-17-22(29)20-11-8-9-12-20)19-24(28(27)33)36-18-10-4-7-15-26(32)35-2/h16-17,19-23,27,29-30H,3-4,6-12,14-15,18H2,1-2H3/b17-16+