(5R,6R)-2-methyl-5-[(2S,4S)-4-oxidanylpentan-2-yl]oxy-6-sulfanyl-hept-3-yn-2-ol

Systemtic Name: (5R,6R)-2-methyl-5-[(2S,4S)-4-oxidanylpentan-2-yl]oxy-6-sulfanyl-hept-3-yn-2-ol Openeye Name: (5R,6R)-5-[(1S,3S)-3-hydroxy-1-methyl-butoxy]-2-methyl-6-sulfanyl-hept-3-yn-2-ol CAS Name: (5R,6R)-5-[(2S,4S)-4-hydroxypentan-2-yl]oxy-6-mercapto-2-methyl-3-heptyn-2-ol IUPAC Name: (5R,6R)-5-[(2S,4S)-4-hydroxypentan-2-yl]oxy-2-methyl-6-sulfanylhept-3-yn-2-ol Traditional Name: (5R,6R)-5-[(1S,3S)-3-hydroxy-1-methyl-butoxy]-6-mercapto-2-methyl-hept-3-yn-2-ol Formula: C13H24O3S MolecularWeight: 260.39286

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)OC(C#CC(C)(C)O)C(C)S)O

Isomeric SMILES

C[C@@H](C[C@H](C)O[C@H](C#CC(C)(C)O)[C@@H](C)S)O

InChI

InChI=1S/C13H24O3S/c1-9(14)8-10(2)16-12(11(3)17)6-7-13(4,5)15/h9-12,14-15,17H,8H2,1-5H3/t9-,10-,11+,12+/m0/s1