7-[(1R,2Z,5S)-2-(3-ethyl-4,4-dimethyl-3-oxidanyl-nonylidene)-5-oxidanyl-cyclopentyl]heptanoic acid

Systemtic Name: 7-[(1R,2Z,5S)-2-(3-ethyl-4,4-dimethyl-3-oxidanyl-nonylidene)-5-oxidanyl-cyclopentyl]heptanoic acid Openeye Name: 7-[(1R,2Z,5S)-2-(3-ethyl-3-hydroxy-4,4-dimethyl-nonylidene)-5-hydroxy-cyclopentyl]heptanoic acid CAS Name: 7-[(1R,2Z,5S)-2-(3-ethyl-3-hydroxy-4,4-dimethylnonylidene)-5-hydroxycyclopentyl]heptanoic acid IUPAC Name: 7-[(1R,2Z,5S)-2-(3-ethyl-3-hydroxy-4,4-dimethylnonylidene)-5-hydroxycyclopentyl]heptanoic acid Traditional Name: 7-[(1R,2Z,5S)-2-(3-ethyl-3-hydroxy-4,4-dimethyl-nonylidene)-5-hydroxy-cyclopentyl]enanthic acid Formula: C25H46O4 MolecularWeight: 410.63034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C(CC)(CC=C1CCC(C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CCCCCC(C)(C)C(CC)(C/C=C\1/CC[C@@H]([C@@H]1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C25H46O4/c1-5-7-12-18-24(3,4)25(29,6-2)19-17-20-15-16-22(26)21(20)13-10-8-9-11-14-23(27)28/h17,21-22,26,29H,5-16,18-19H2,1-4H3,(H,27,28)/b20-17-/t21-,22+,25?/m1/s1