8-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3-methyl-3,10-bis(oxidanyl)-1-propyl-1,4-dihydrobenzo[g]isochromene-6,9-dione

Systemtic Name: 8-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3-methyl-3,10-bis(oxidanyl)-1-propyl-1,4-dihydrobenzo[g]isochromene-6,9-dione Openeye Name: 8-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3,10-dihydroxy-3-methyl-1-propyl-1,4-dihydrobenzo[g]isochromene-6,9-dione CAS Name: 8-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-3,10-dihydroxy-3-methyl-1-propyl-1,4-dihydrobenzo[g][2]benzopyran-6,9-dione IUPAC Name: 8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,10-dihydroxy-3-methyl-1-propyl-1,4-dihydrobenzo[g]isochromene-6,9-dione Traditional Name: 8-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-3,10-dihydroxy-3-methyl-1-propyl-1,4-dihydrobenz[g]isochromene-6,9-quinone Formula: C22H26O9 MolecularWeight: 434.43644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=C(CC(O1)(C)O)C=C3C(=O)C=C(C(=O)C3=C2O)C4C(C(C(O4)CO)O)O

Isomeric SMILES

CCCC1C2=C(CC(O1)(C)O)C=C3C(=O)C=C(C(=O)C3=C2O)C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C22H26O9/c1-3-4-13-15-9(7-22(2,29)31-13)5-10-12(24)6-11(17(25)16(10)19(15)27)21-20(28)18(26)14(8-23)30-21/h5-6,13-14,18,20-21,23,26-29H,3-4,7-8H2,1-2H3