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

Systemtic Name: [3,4,5-triacetyloxy-6-(3-octoxy-2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxy-oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(2-hydroxy-3-octoxy-4-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[(2-hydroxy-3-octoxy-4-oxo-1-benzopyran-7-yl)oxy]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(2-hydroxy-3-octoxy-4-oxochromen-7-yl)oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(2-hydroxy-4-keto-3-octoxy-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl ester Formula: C31H40O14 MolecularWeight: 636.6409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O

Isomeric SMILES

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O

InChI

InChI=1S/C31H40O14/c1-6-7-8-9-10-11-14-38-27-25(36)22-13-12-21(15-23(22)44-30(27)37)43-31-29(42-20(5)35)28(41-19(4)34)26(40-18(3)33)24(45-31)16-39-17(2)32/h12-13,15,24,26,28-29,31,37H,6-11,14,16H2,1-5H3