3-[4,5-bis(oxidanyl)-3-oxidanylidene-hexan-2-yl]-7-methyl-8,9-bis(oxidanyl)-3,4-dihydro-2H-anthracen-1-one

Systemtic Name: 3-[4,5-bis(oxidanyl)-3-oxidanylidene-hexan-2-yl]-7-methyl-8,9-bis(oxidanyl)-3,4-dihydro-2H-anthracen-1-one Openeye Name: 3-(3,4-dihydroxy-1-methyl-2-oxo-pentyl)-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one CAS Name: 3-(4,5-dihydroxy-3-oxohexan-2-yl)-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one IUPAC Name: 3-(4,5-dihydroxy-3-oxohexan-2-yl)-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one Traditional Name: 3-(3,4-dihydroxy-2-keto-1-methyl-pentyl)-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C3=C(CC(CC3=O)C(C)C(=O)C(C(C)O)O)C=C2C=C1)O)O

Isomeric SMILES

CC1=C(C2=C(C3=C(CC(CC3=O)C(C)C(=O)C(C(C)O)O)C=C2C=C1)O)O

InChI

InChI=1S/C21H24O6/c1-9-4-5-12-6-14-7-13(10(2)19(25)20(26)11(3)22)8-15(23)16(14)21(27)17(12)18(9)24/h4-6,10-11,13,20,22,24,26-27H,7-8H2,1-3H3