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

Systemtic Name: (5R,6R)-2-methyl-5-[(2R,3R)-3-oxidanylbutan-2-yl]oxy-6-sulfanyl-hept-3-yn-2-ol Openeye Name: (5R,6R)-5-[(1R,2R)-2-hydroxy-1-methyl-propoxy]-2-methyl-6-sulfanyl-hept-3-yn-2-ol CAS Name: (5R,6R)-5-[(2R,3R)-3-hydroxybutan-2-yl]oxy-6-mercapto-2-methyl-3-heptyn-2-ol IUPAC Name: (5R,6R)-5-[(2R,3R)-3-hydroxybutan-2-yl]oxy-2-methyl-6-sulfanylhept-3-yn-2-ol Traditional Name: (5R,6R)-5-[(1R,2R)-2-hydroxy-1-methyl-propoxy]-6-mercapto-2-methyl-hept-3-yn-2-ol Formula: C12H22O3S MolecularWeight: 246.36628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O3S/c1-8(13)9(2)15-11(10(3)16)6-7-12(4,5)14/h8-11,13-14,16H,1-5H3/t8-,9-,10-,11-/m1/s1