2-ethanoyl-4-methoxy-3,10,11,12a-tetrakis(oxidanyl)-4a,5-dihydro-4H-tetracene-1,12-dione

Systemtic Name: 2-ethanoyl-4-methoxy-3,10,11,12a-tetrakis(oxidanyl)-4a,5-dihydro-4H-tetracene-1,12-dione Openeye Name: 2-acetyl-3,10,11,12a-tetrahydroxy-4-methoxy-4a,5-dihydro-4H-tetracene-1,12-dione CAS Name: 2-acetyl-3,10,11,12a-tetrahydroxy-4-methoxy-4a,5-dihydro-4H-tetracene-1,12-dione IUPAC Name: 2-acetyl-3,10,11,12a-tetrahydroxy-4-methoxy-4a,5-dihydro-4H-tetracene-1,12-dione Traditional Name: 2-acetyl-3,10,11,12a-tetrahydroxy-4-methoxy-4a,5-dihydro-4H-tetracene-1,12-quinone Formula: C21H18O8 MolecularWeight: 398.36282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(C2CC3=C(C(=C4C(=C3)C=CC=C4O)O)C(=O)C2(C1=O)O)OC)O

Isomeric SMILES

CC(=O)C1=C(C(C2CC3=C(C(=C4C(=C3)C=CC=C4O)O)C(=O)C2(C1=O)O)OC)O

InChI

InChI=1S/C21H18O8/c1-8(22)13-17(25)18(29-2)11-7-10-6-9-4-3-5-12(23)14(9)16(24)15(10)20(27)21(11,28)19(13)26/h3-6,11,18,23-25,28H,7H2,1-2H3