(2S,3S,6S,8R)-2-methyl-3,6-bis(oxidanyl)-8-phenylmethoxy-nonanoic acid

Systemtic Name: (2S,3S,6S,8R)-2-methyl-3,6-bis(oxidanyl)-8-phenylmethoxy-nonanoic acid Openeye Name: (2S,3S,6S,8R)-8-benzyloxy-3,6-dihydroxy-2-methyl-nonanoic acid CAS Name: (2S,3S,6S,8R)-3,6-dihydroxy-2-methyl-8-phenylmethoxynonanoic acid IUPAC Name: (2S,3S,6S,8R)-3,6-dihydroxy-2-methyl-8-phenylmethoxynonanoic acid Traditional Name: (2S,3S,6S,8R)-8-benzoxy-3,6-dihydroxy-2-methyl-pelargonic acid Formula: C17H26O5 MolecularWeight: 310.38534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CCC(C(C)C(=O)O)O)O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@H](C[C@H](CC[C@@H]([C@H](C)C(=O)O)O)O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H26O5/c1-12(22-11-14-6-4-3-5-7-14)10-15(18)8-9-16(19)13(2)17(20)21/h3-7,12-13,15-16,18-19H,8-11H2,1-2H3,(H,20,21)/t12-,13+,15+,16+/m1/s1