2-[5-[7-[2,3-bis(oxidanyl)propoxy]-5-oxidanyl-4-oxidanylidene-chromen-2-yl]-2-oxidanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[5-[7-[2,3-bis(oxidanyl)propoxy]-5-oxidanyl-4-oxidanylidene-chromen-2-yl]-2-oxidanyl-phenoxy]ethanoic acid Openeye Name: 2-[5-[7-(2,3-dihydroxypropoxy)-5-hydroxy-4-oxo-chromen-2-yl]-2-hydroxy-phenoxy]acetic acid CAS Name: 2-[5-[7-(2,3-dihydroxypropoxy)-5-hydroxy-4-oxo-1-benzopyran-2-yl]-2-hydroxyphenoxy]acetic acid IUPAC Name: 2-[5-[7-(2,3-dihydroxypropoxy)-5-hydroxy-4-oxochromen-2-yl]-2-hydroxyphenoxy]acetic acid Traditional Name: 2-[5-(7-glyceryloxy-5-hydroxy-4-keto-chromen-2-yl)-2-hydroxy-phenoxy]acetic acid Formula: C20H18O10 MolecularWeight: 418.35092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OCC(CO)O)O)OCC(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OCC(CO)O)O)OCC(=O)O)O

InChI

InChI=1S/C20H18O10/c21-7-11(22)8-28-12-4-14(24)20-15(25)6-16(30-18(20)5-12)10-1-2-13(23)17(3-10)29-9-19(26)27/h1-6,11,21-24H,7-9H2,(H,26,27)