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

Systemtic Name: 4-decoxy-7-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-chromen-2-one Openeye Name: 4-decoxy-3-hydroxy-7-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-2-one CAS Name: 4-decoxy-3-hydroxy-7-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-benzopyran-2-one IUPAC Name: 4-decoxy-3-hydroxy-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one Traditional Name: 4-decoxy-3-hydroxy-7-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-coumarin Formula: C25H36O10 MolecularWeight: 496.54734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O

InChI

InChI=1S/C25H36O10/c1-2-3-4-5-6-7-8-9-12-32-23-16-11-10-15(13-17(16)34-24(31)22(23)30)33-25-21(29)20(28)19(27)18(14-26)35-25/h10-11,13,18-21,25-30H,2-9,12,14H2,1H3