5-[(2S)-2-methylhex-5-enyl]-2-[(1R,2S)-5-methyl-1-oxidanyl-2-propan-2-yl-hex-5-enyl]furan-3-carboxylic acid

Systemtic Name: 5-[(2S)-2-methylhex-5-enyl]-2-[(1R,2S)-5-methyl-1-oxidanyl-2-propan-2-yl-hex-5-enyl]furan-3-carboxylic acid Openeye Name: 2-[(1R,2S)-1-hydroxy-2-isopropyl-5-methyl-hex-5-enyl]-5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid CAS Name: 2-[(1R,2S)-1-hydroxy-5-methyl-2-propan-2-ylhex-5-enyl]-5-[(2S)-2-methylhex-5-enyl]-3-furancarboxylic acid IUPAC Name: 2-[(1R,2S)-1-hydroxy-5-methyl-2-propan-2-ylhex-5-enyl]-5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid Traditional Name: 2-[(1R,2S)-1-hydroxy-2-isopropyl-5-methyl-hex-5-enyl]-5-[(2S)-2-methylhex-5-enyl]-3-furoic acid Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(=C)C)C(C1=C(C=C(O1)CC(C)CCC=C)C(=O)O)O

Isomeric SMILES

C[C@@H](CCC=C)CC1=CC(=C(O1)[C@@H]([C@@H](CCC(=C)C)C(C)C)O)C(=O)O

InChI

InChI=1S/C22H34O4/c1-7-8-9-16(6)12-17-13-19(22(24)25)21(26-17)20(23)18(15(4)5)11-10-14(2)3/h7,13,15-16,18,20,23H,1-2,8-12H2,3-6H3,(H,24,25)/t16-,18-,20+/m0/s1