7-[5-methoxy-6,6-dimethyl-3,4-bis(oxidanyl)oxan-2-yl]oxy-8-methyl-3-(2-methylsulfanylethanoyl)-2-oxidanyl-chromen-4-one

Systemtic Name: 7-[5-methoxy-6,6-dimethyl-3,4-bis(oxidanyl)oxan-2-yl]oxy-8-methyl-3-(2-methylsulfanylethanoyl)-2-oxidanyl-chromen-4-one Openeye Name: 7-(3,4-dihydroxy-5-methoxy-6,6-dimethyl-tetrahydropyran-2-yl)oxy-2-hydroxy-8-methyl-3-(2-methylsulfanylacetyl)chromen-4-one CAS Name: 7-[(3,4-dihydroxy-5-methoxy-6,6-dimethyl-2-oxanyl)oxy]-2-hydroxy-8-methyl-3-[2-(methylthio)-1-oxoethyl]-1-benzopyran-4-one IUPAC Name: 7-(3,4-dihydroxy-5-methoxy-6,6-dimethyloxan-2-yl)oxy-2-hydroxy-8-methyl-3-(2-methylsulfanylacetyl)chromen-4-one Traditional Name: 7-(3,4-dihydroxy-5-methoxy-6,6-dimethyl-tetrahydropyran-2-yl)oxy-2-hydroxy-8-methyl-3-[2-(methylthio)acetyl]chromone Formula: C21H26O9S MolecularWeight: 454.49074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=C(C2=O)C(=O)CSC)O)OC3C(C(C(C(O3)(C)C)OC)O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=C(C2=O)C(=O)CSC)O)OC3C(C(C(C(O3)(C)C)OC)O)O

InChI

InChI=1S/C21H26O9S/c1-9-12(28-20-16(25)15(24)18(27-4)21(2,3)30-20)7-6-10-14(23)13(11(22)8-31-5)19(26)29-17(9)10/h6-7,15-16,18,20,24-26H,8H2,1-5H3