S-tert-butyl (2R,3R,4R,5R)-2-methoxy-8-methyl-3-oxidanyl-4,5-bis(phenylmethoxy)non-6-ynethioate

Systemtic Name: S-tert-butyl (2R,3R,4R,5R)-2-methoxy-8-methyl-3-oxidanyl-4,5-bis(phenylmethoxy)non-6-ynethioate Openeye Name: S-tert-butyl (2R,3R,4R,5R)-4,5-dibenzyloxy-3-hydroxy-2-methoxy-8-methyl-non-6-ynethioate CAS Name: (2R,3R,4R,5R)-3-hydroxy-2-methoxy-8-methyl-4,5-bis(phenylmethoxy)-6-nonynethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (2R,3R,4R,5R)-3-hydroxy-2-methoxy-8-methyl-4,5-bis(phenylmethoxy)non-6-ynethioate Traditional Name: (2R,3R,4R,5R)-4,5-dibenzoxy-3-hydroxy-2-methoxy-8-methyl-non-6-ynethioic acid S-tert-butyl ester Formula: C29H38O5S MolecularWeight: 498.67402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC(C(C(C(C(=O)SC(C)(C)C)OC)O)OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C#C[C@H]([C@@H]([C@H]([C@H](C(=O)SC(C)(C)C)OC)O)OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C29H38O5S/c1-21(2)17-18-24(33-19-22-13-9-7-10-14-22)26(34-20-23-15-11-8-12-16-23)25(30)27(32-6)28(31)35-29(3,4)5/h7-16,21,24-27,30H,19-20H2,1-6H3/t24-,25-,26+,27-/m1/s1