3-[(4R,5S,6R)-6-ethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-1-methyl-8-oxidanyl-anthracene-9,10-dione

Systemtic Name: 3-[(4R,5S,6R)-6-ethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-1-methyl-8-oxidanyl-anthracene-9,10-dione Openeye Name: 3-[(4R,5S,6R)-6-ethyl-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-8-hydroxy-1-methyl-anthracene-9,10-dione CAS Name: 3-[[(4R,5S,6R)-6-ethyl-4,5-dihydroxy-2-oxanyl]oxy]-8-hydroxy-1-methylanthracene-9,10-dione IUPAC Name: 3-[(4R,5S,6R)-6-ethyl-4,5-dihydroxyoxan-2-yl]oxy-8-hydroxy-1-methylanthracene-9,10-dione Traditional Name: 3-[(4R,5S,6R)-6-ethyl-4,5-dihydroxy-tetrahydropyran-2-yl]oxy-8-hydroxy-1-methyl-9,10-anthraquinone Formula: C22H22O7 MolecularWeight: 398.40588

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(CC(O1)OC2=CC(=C3C(=C2)C(=O)C4=C(C3=O)C(=CC=C4)O)C)O)O

Isomeric SMILES

CC[C@@H]1[C@H]([C@@H](CC(O1)OC2=CC(=C3C(=C2)C(=O)C4=C(C3=O)C(=CC=C4)O)C)O)O

InChI

InChI=1S/C22H22O7/c1-3-16-21(26)15(24)9-17(29-16)28-11-7-10(2)18-13(8-11)20(25)12-5-4-6-14(23)19(12)22(18)27/h4-8,15-17,21,23-24,26H,3,9H2,1-2H3/t15-,16-,17?,21+/m1/s1