(3aS,5S,8aR,9aR)-3-(hydroxymethyl)-5,8a-dimethyl-3-oxidanyl-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one

Systemtic Name: (3aS,5S,8aR,9aR)-3-(hydroxymethyl)-5,8a-dimethyl-3-oxidanyl-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one Openeye Name: (3aS,5S,8aR,9aR)-3-hydroxy-3-(hydroxymethyl)-5,8a-dimethyl-5,6,7,8,9,9a-hexahydro-3aH-benzo[f]benzofuran-2-one CAS Name: (3aS,5S,8aR,9aR)-3-hydroxy-3-(hydroxymethyl)-5,8a-dimethyl-5,6,7,8,9,9a-hexahydro-3aH-benzo[f]benzofuran-2-one IUPAC Name: (3aS,5S,8aR,9aR)-3-hydroxy-3-(hydroxymethyl)-5,8a-dimethyl-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one Traditional Name: (3aS,5S,8aR,9aR)-3-hydroxy-5,8a-dimethyl-3-methylol-5,6,7,8,9,9a-hexahydro-3aH-benzo[f]benzofuran-2-one Formula: C15H22O4 MolecularWeight: 266.33278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2(C1=CC3C(C2)OC(=O)C3(CO)O)C

Isomeric SMILES

C[C@H]1CCC[C@]2(C1=C[C@H]3[C@@H](C2)OC(=O)C3(CO)O)C

InChI

InChI=1S/C15H22O4/c1-9-4-3-5-14(2)7-12-11(6-10(9)14)15(18,8-16)13(17)19-12/h6,9,11-12,16,18H,3-5,7-8H2,1-2H3/t9-,11-,12+,14+,15?/m0/s1