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

Systemtic Name: 7-butoxy-3-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-phenylmethoxy-chromen-2-one Openeye Name: 4-benzyloxy-7-butoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one CAS Name: 7-butoxy-4-phenylmethoxy-3-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-benzopyran-2-one IUPAC Name: 7-butoxy-4-phenylmethoxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one Traditional Name: 4-benzoxy-7-butoxy-3-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-coumarin Formula: C26H30O10 MolecularWeight: 502.5104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H30O10/c1-2-3-11-32-16-9-10-17-18(12-16)34-25(31)24(23(17)33-14-15-7-5-4-6-8-15)36-26-22(30)21(29)20(28)19(13-27)35-26/h4-10,12,19-22,26-30H,2-3,11,13-14H2,1H3