(2S)-2-[(6R,7R)-6-methyl-7-oxidanyl-octyl]-2H-furan-5-one

Systemtic Name: (2S)-2-[(6R,7R)-6-methyl-7-oxidanyl-octyl]-2H-furan-5-one Openeye Name: (2S)-2-[(6R,7R)-7-hydroxy-6-methyl-octyl]-2H-furan-5-one CAS Name: (2S)-2-[(6R,7R)-7-hydroxy-6-methyloctyl]-2H-furan-5-one IUPAC Name: (2S)-2-[(6R,7R)-7-hydroxy-6-methyloctyl]-2H-furan-5-one Traditional Name: (2S)-2-[(6R,7R)-7-hydroxy-6-methyl-octyl]-2H-furan-5-one Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC1C=CC(=O)O1)C(C)O

Isomeric SMILES

C[C@H](CCCCC[C@H]1C=CC(=O)O1)[C@@H](C)O

InChI

InChI=1S/C13H22O3/c1-10(11(2)14)6-4-3-5-7-12-8-9-13(15)16-12/h8-12,14H,3-7H2,1-2H3/t10-,11-,12+/m1/s1