4-[2-methoxy-6-methyl-4-[2-methyl-3,4,6-tris(oxidanyl)phenyl]carbonyloxy-phenyl]carbonyloxy-2-methyl-6-oxidanyl-benzoic acid

Systemtic Name: 4-[2-methoxy-6-methyl-4-[2-methyl-3,4,6-tris(oxidanyl)phenyl]carbonyloxy-phenyl]carbonyloxy-2-methyl-6-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[2-methoxy-6-methyl-4-(3,4,6-trihydroxy-2-methyl-benzoyl)oxy-benzoyl]oxy-6-methyl-benzoic acid CAS Name: 2-hydroxy-4-[[2-methoxy-6-methyl-4-[oxo-(3,4,6-trihydroxy-2-methylphenyl)methoxy]phenyl]-oxomethoxy]-6-methylbenzoic acid IUPAC Name: 2-hydroxy-4-[2-methoxy-6-methyl-4-(3,4,6-trihydroxy-2-methylbenzoyl)oxybenzoyl]oxy-6-methylbenzoic acid Traditional Name: 2-hydroxy-4-[2-methoxy-6-methyl-4-(3,4,6-trihydroxy-2-methyl-benzoyl)oxy-benzoyl]oxy-6-methyl-benzoic acid Formula: C25H22O11 MolecularWeight: 498.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2C)OC(=O)C3=C(C(=C(C=C3O)O)O)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)O)O)OC(=O)C2=C(C=C(C=C2C)OC(=O)C3=C(C(=C(C=C3O)O)O)C)OC

InChI

InChI=1S/C25H22O11/c1-10-5-13(7-15(26)19(10)23(30)31)35-24(32)20-11(2)6-14(8-18(20)34-4)36-25(33)21-12(3)22(29)17(28)9-16(21)27/h5-9,26-29H,1-4H3,(H,30,31)