(Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid

Systemtic Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-3,5-bis(oxidanyl)cyclopentyl]hept-5-enoic acid Openeye Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-3,5-dihydroxy-cyclopentyl]hept-5-enoic acid CAS Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-3-(2,2-dimethyl-1-oxopropoxy)oct-1-enyl]-3,5-dihydroxycyclopentyl]-5-heptenoic acid IUPAC Name: (Z)-7-[(1R,2R,3R,5S)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-3,5-dihydroxycyclopentyl]hept-5-enoic acid Traditional Name: (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-pivaloyloxyoct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C25H42O6 MolecularWeight: 438.59738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)OC(=O)C(C)(C)C

Isomeric SMILES

CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O)OC(=O)C(C)(C)C

InChI

InChI=1S/C25H42O6/c1-5-6-9-12-18(31-24(30)25(2,3)4)15-16-20-19(21(26)17-22(20)27)13-10-7-8-11-14-23(28)29/h7,10,15-16,18-22,26-27H,5-6,8-9,11-14,17H2,1-4H3,(H,28,29)/b10-7-,16-15+/t18-,19+,20+,21-,22+/m0/s1