4-[6-methoxy-2,4-bis(oxidanyl)-3-(phenylcarbonyl)phenyl]-1,2,5-tris(oxidanyl)xanthen-9-one

Systemtic Name: 4-[6-methoxy-2,4-bis(oxidanyl)-3-(phenylcarbonyl)phenyl]-1,2,5-tris(oxidanyl)xanthen-9-one Openeye Name: 4-(3-benzoyl-2,4-dihydroxy-6-methoxy-phenyl)-1,2,5-trihydroxy-xanthen-9-one CAS Name: 4-(3-benzoyl-2,4-dihydroxy-6-methoxyphenyl)-1,2,5-trihydroxy-9-xanthenone IUPAC Name: 4-(3-benzoyl-2,4-dihydroxy-6-methoxyphenyl)-1,2,5-trihydroxyxanthen-9-one Traditional Name: 4-(3-benzoyl-2,4-dihydroxy-6-methoxy-phenyl)-1,2,5-trihydroxy-xanthone Formula: C27H18O9 MolecularWeight: 486.42642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1C2=CC(=C(C3=C2OC4=C(C3=O)C=CC=C4O)O)O)O)C(=O)C5=CC=CC=C5)O

Isomeric SMILES

COC1=CC(=C(C(=C1C2=CC(=C(C3=C2OC4=C(C3=O)C=CC=C4O)O)O)O)C(=O)C5=CC=CC=C5)O

InChI

InChI=1S/C27H18O9/c1-35-18-11-16(29)20(22(31)12-6-3-2-4-7-12)25(34)19(18)14-10-17(30)24(33)21-23(32)13-8-5-9-15(28)26(13)36-27(14)21/h2-11,28-30,33-34H,1H3