4-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-7-octoxy-3-oxidanyl-chromen-2-one

Systemtic Name: 4-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-7-octoxy-3-oxidanyl-chromen-2-one Openeye Name: 3-hydroxy-7-octoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one CAS Name: 3-hydroxy-7-octoxy-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-benzopyran-2-one IUPAC Name: 3-hydroxy-7-octoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one Traditional Name: 3-hydroxy-7-octoxy-4-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-coumarin Formula: C23H32O10 MolecularWeight: 468.49418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)O)OC3C(C(C(C(O3)CO)O)O)O

Isomeric SMILES

CCCCCCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)O)OC3C(C(C(C(O3)CO)O)O)O

InChI

InChI=1S/C23H32O10/c1-2-3-4-5-6-7-10-30-13-8-9-14-15(11-13)31-22(29)20(28)21(14)33-23-19(27)18(26)17(25)16(12-24)32-23/h8-9,11,16-19,23-28H,2-7,10,12H2,1H3