7-[3-(2-carboxy-4-oxidanylidene-5-phenylmethoxy-chromen-7-yl)oxy-2-oxidanyl-propoxy]-4-oxidanylidene-5-phenylmethoxy-chromene-2-carboxylic acid

Systemtic Name: 7-[3-(2-carboxy-4-oxidanylidene-5-phenylmethoxy-chromen-7-yl)oxy-2-oxidanyl-propoxy]-4-oxidanylidene-5-phenylmethoxy-chromene-2-carboxylic acid Openeye Name: 5-benzyloxy-7-[3-(5-benzyloxy-2-carboxy-4-oxo-chromen-7-yl)oxy-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid CAS Name: 7-[3-[(2-carboxy-4-oxo-5-phenylmethoxy-1-benzopyran-7-yl)oxy]-2-hydroxypropoxy]-4-oxo-5-phenylmethoxy-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(2-carboxy-4-oxo-5-phenylmethoxychromen-7-yl)oxy-2-hydroxypropoxy]-4-oxo-5-phenylmethoxychromene-2-carboxylic acid Traditional Name: 5-benzoxy-7-[3-(5-benzoxy-2-carboxy-4-keto-chromen-7-yl)oxy-2-hydroxy-propoxy]-4-keto-chromene-2-carboxylic acid Formula: C37H28O13 MolecularWeight: 680.61042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C3C(=CC(=C2)OCC(COC4=CC(=C5C(=C4)OC(=CC5=O)C(=O)O)OCC6=CC=CC=C6)O)OC(=CC3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C3C(=CC(=C2)OCC(COC4=CC(=C5C(=C4)OC(=CC5=O)C(=O)O)OCC6=CC=CC=C6)O)OC(=CC3=O)C(=O)O

InChI

InChI=1S/C37H28O13/c38-23(19-45-24-11-28(47-17-21-7-3-1-4-8-21)34-26(39)15-32(36(41)42)49-30(34)13-24)20-46-25-12-29(48-18-22-9-5-2-6-10-22)35-27(40)16-33(37(43)44)50-31(35)14-25/h1-16,23,38H,17-20H2,(H,41,42)(H,43,44)