5-[(3aS,6R,6aS)-6-(4-fluoranyl-3-oxidanylidene-octyl)-5-oxidanyl-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid

Systemtic Name: 5-[(3aS,6R,6aS)-6-(4-fluoranyl-3-oxidanylidene-octyl)-5-oxidanyl-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid Openeye Name: 5-[(3aS,6R,6aS)-6-(4-fluoro-3-oxo-octyl)-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid CAS Name: 5-[(3aS,6R,6aS)-6-(4-fluoro-3-oxooctyl)-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid IUPAC Name: 5-[(3aS,6R,6aS)-6-(4-fluoro-3-oxooctyl)-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoic acid Traditional Name: 5-[(3aS,6R,6aS)-6-(4-fluoro-3-keto-octyl)-5-hydroxy-1,3a,4,5,6,6a-hexahydropentalen-2-yl]valeric acid Formula: C21H33FO4 MolecularWeight: 368.482723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CCC1C(CC2C1CC(=C2)CCCCC(=O)O)O)F

Isomeric SMILES

CCCCC(C(=O)CC[C@@H]1[C@H]2CC(=C[C@H]2CC1O)CCCCC(=O)O)F

InChI

InChI=1S/C21H33FO4/c1-2-3-7-18(22)19(23)10-9-16-17-12-14(6-4-5-8-21(25)26)11-15(17)13-20(16)24/h11,15-18,20,24H,2-10,12-13H2,1H3,(H,25,26)/t15-,16+,17-,18?,20?/m0/s1