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

Systemtic Name: (E)-7-[(1R,3R,5S)-3-(2,2-dimethylpropanoyloxy)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-5-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[(1R,3R,5S)-3-(2,2-dimethylpropanoyloxy)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-5-hydroxy-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[(1R,3R,5S)-3-(2,2-dimethyl-1-oxopropoxy)-2-[(E,3S)-3-(2,2-dimethyl-1-oxopropoxy)oct-1-enyl]-5-hydroxycyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[(1R,3R,5S)-3-(2,2-dimethylpropanoyloxy)-2-[(E,3S)-3-(2,2-dimethylpropanoyloxy)oct-1-enyl]-5-hydroxycyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[(1R,3R,5S)-5-hydroxy-3-pivaloyloxy-2-[(E,3S)-3-pivaloyloxyoct-1-enyl]cyclopentyl]hept-5-enoic acid Formula: C30H50O7 MolecularWeight: 522.7138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC[C@@H](/C=C/C1[C@@H](C[C@@H]([C@@H]1C/C=C/CCCC(=O)O)O)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C

InChI

InChI=1S/C30H50O7/c1-8-9-12-15-21(36-27(34)29(2,3)4)18-19-23-22(16-13-10-11-14-17-26(32)33)24(31)20-25(23)37-28(35)30(5,6)7/h10,13,18-19,21-25,31H,8-9,11-12,14-17,20H2,1-7H3,(H,32,33)/b13-10+,19-18+/t21-,22+,23?,24-,25+/m0/s1