(3R,4R,5S)-4,5-dimethyl-3-(3-methyl-2-oxidanylidene-pentyl)-5-oxidanyl-oxolan-2-one

Systemtic Name: (3R,4R,5S)-4,5-dimethyl-3-(3-methyl-2-oxidanylidene-pentyl)-5-oxidanyl-oxolan-2-one Openeye Name: (3R,4R,5S)-5-hydroxy-4,5-dimethyl-3-(3-methyl-2-oxo-pentyl)tetrahydrofuran-2-one CAS Name: (3R,4R,5S)-5-hydroxy-4,5-dimethyl-3-(3-methyl-2-oxopentyl)-2-oxolanone IUPAC Name: (3R,4R,5S)-5-hydroxy-4,5-dimethyl-3-(3-methyl-2-oxopentyl)oxolan-2-one Traditional Name: (3R,4R,5S)-5-hydroxy-3-(2-keto-3-methyl-pentyl)-4,5-dimethyl-tetrahydrofuran-2-one Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)CC1C(C(OC1=O)(C)O)C

Isomeric SMILES

CCC(C)C(=O)C[C@@H]1[C@H]([C@@](OC1=O)(C)O)C

InChI

InChI=1S/C12H20O4/c1-5-7(2)10(13)6-9-8(3)12(4,15)16-11(9)14/h7-9,15H,5-6H2,1-4H3/t7?,8-,9-,12+/m1/s1