(3R,3aR,8aS,9aR)-3,8a-bis(hydroxymethyl)-5-methyl-3,8-bis(oxidanyl)-9,9a-dihydro-3aH-benzo[f][1]benzofuran-2-one

Systemtic Name: (3R,3aR,8aS,9aR)-3,8a-bis(hydroxymethyl)-5-methyl-3,8-bis(oxidanyl)-9,9a-dihydro-3aH-benzo[f][1]benzofuran-2-one Openeye Name: (3R,3aR,8aS,9aR)-3,8-dihydroxy-3,8a-bis(hydroxymethyl)-5-methyl-9,9a-dihydro-3aH-benzo[f]benzofuran-2-one CAS Name: (3R,3aR,8aS,9aR)-3,8-dihydroxy-3,8a-bis(hydroxymethyl)-5-methyl-9,9a-dihydro-3aH-benzo[f]benzofuran-2-one IUPAC Name: (3R,3aR,8aS,9aR)-3,8-dihydroxy-3,8a-bis(hydroxymethyl)-5-methyl-9,9a-dihydro-3aH-benzo[f][1]benzofuran-2-one Traditional Name: (3R,3aR,8aS,9aR)-3,8-dihydroxy-5-methyl-3,8a-dimethylol-9,9a-dihydro-3aH-benzo[f]benzofuran-2-one Formula: C15H18O6 MolecularWeight: 294.29982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2(C1=CC3C(C2)OC(=O)C3(CO)O)CO)O

Isomeric SMILES

CC1=CC=C([C@@]2(C1=C[C@@H]3[C@@H](C2)OC(=O)[C@@]3(CO)O)CO)O

InChI

InChI=1S/C15H18O6/c1-8-2-3-12(18)14(6-16)5-11-10(4-9(8)14)15(20,7-17)13(19)21-11/h2-4,10-11,16-18,20H,5-7H2,1H3/t10-,11-,14-,15+/m1/s1