(3S,4S,5R,6S)-5-methyl-3,4-bis(oxidanyl)-6-pentyl-oxan-2-one

Systemtic Name: (3S,4S,5R,6S)-5-methyl-3,4-bis(oxidanyl)-6-pentyl-oxan-2-one Openeye Name: (3S,4S,5R,6S)-3,4-dihydroxy-5-methyl-6-pentyl-tetrahydropyran-2-one CAS Name: (3S,4S,5R,6S)-3,4-dihydroxy-5-methyl-6-pentyl-2-oxanone IUPAC Name: (3S,4S,5R,6S)-3,4-dihydroxy-5-methyl-6-pentyloxan-2-one Traditional Name: (3S,4S,5R,6S)-6-amyl-3,4-dihydroxy-5-methyl-tetrahydropyran-2-one Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O4/c1-3-4-5-6-8-7(2)9(12)10(13)11(14)15-8/h7-10,12-13H,3-6H2,1-2H3/t7-,8-,9-,10-/m0/s1