[3,4,5-triacetyloxy-6-(3-decoxy-2-oxidanylidene-4-phenylmethoxy-chromen-7-yl)oxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(3-decoxy-2-oxidanylidene-4-phenylmethoxy-chromen-7-yl)oxy-oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(4-benzyloxy-3-decoxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[(3-decoxy-2-oxo-4-phenylmethoxy-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(3-decoxy-2-oxo-4-phenylmethoxychromen-7-yl)oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(4-benzoxy-3-decoxy-2-keto-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl ester Formula: C40H50O14 MolecularWeight: 754.8166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C2=C(C=C(C=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC1=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC1=C(C2=C(C=C(C=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC1=O)OCC4=CC=CC=C4

InChI

InChI=1S/C40H50O14/c1-6-7-8-9-10-11-12-16-21-46-37-34(48-23-29-17-14-13-15-18-29)31-20-19-30(22-32(31)53-39(37)45)52-40-38(51-28(5)44)36(50-27(4)43)35(49-26(3)42)33(54-40)24-47-25(2)41/h13-15,17-20,22,33,35-36,38,40H,6-12,16,21,23-24H2,1-5H3