Fenestrel

Molecular structure via molpic based on CDK

Rotamer []
Conformer structure via 3Dmol.js
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Physical properties []
Molecular mass	244.33 g/mol [1]
Predicted LogP	3.8 [1]

Structural Identifiers []
Molecular formula	C16H20O2 [1]
IUPAC name	5-ethyl-6-methyl-4-phenylcyclohex-3-ene-1-carboxylic acid [1]
SMILES	CCC1C(C(CC=C1C2=CC=CC=C2)C(=O)O)C [1]
InChI	InChI=1S/C16H20O2/c1-3-13-11(2)14(16(17)18)9-10-15(13)12-7-5-4-6-8-12/h4-8,10-11,13-14H,3,9H2,1-2H3,(H,17,18) [1]
InChIKey	CLMFEXDZPBGYQQ-UHFFFAOYSA-N [1]

Fenestrel

Fenestrel (also known as Fenestrelum, Fenestrelo, ORF 3858, 5-Ethyl-6-methyl-4-phenyl-3-cyclohexene-1-carboxylic acid, AI3-62334, 3-Cyclohexene-1-carboxylic acid, 5-ethyl-6-methyl-4-phenyl-, 2-Methyl-3-ethyl-4-phenyl-4-cyclohexene carboxylic acid, 2-Methyl-3-ethyl-4-phenyl-4-cyclohexenecarboxylic acid, 2-Methyl-3-ethyl-4-phenyl-Δ(sup 4)-cyclohexenecarboxylic acid or Demethoxyhoggolic acid)

Chemistry