8-(hydroxymethyl)-3a-oxidanyl-1,2,3,8b-tetrahydrocyclopenta[b][1]benzofuran-5-carboxylic acid

Systemtic Name: 8-(hydroxymethyl)-3a-oxidanyl-1,2,3,8b-tetrahydrocyclopenta[b][1]benzofuran-5-carboxylic acid Openeye Name: 3a-hydroxy-8-(hydroxymethyl)-1,2,3,8b-tetrahydrocyclopenta[b]benzofuran-5-carboxylic acid CAS Name: 3a-hydroxy-8-(hydroxymethyl)-1,2,3,8b-tetrahydrocyclopenta[b]benzofuran-5-carboxylic acid IUPAC Name: 3a-hydroxy-8-(hydroxymethyl)-1,2,3,8b-tetrahydrocyclopenta[b][1]benzofuran-5-carboxylic acid Traditional Name: 3a-hydroxy-8-methylol-1,2,3,8b-tetrahydrocyclopenta[b]benzofuran-5-carboxylic acid Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C3=C(C=CC(=C3OC2(C1)O)C(=O)O)CO

Isomeric SMILES

C1CC2C3=C(C=CC(=C3OC2(C1)O)C(=O)O)CO

InChI

InChI=1S/C13H14O5/c14-6-7-3-4-8(12(15)16)11-10(7)9-2-1-5-13(9,17)18-11/h3-4,9,14,17H,1-2,5-6H2,(H,15,16)