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6-[2,6-dimethoxy-4-[5-[[7-methyl-2,8-bis(oxidanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

6-[2,6-dimethoxy-4-[5-[[7-methyl-2,8-bis(oxidanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid

Systemtic Name:6-[2,6-dimethoxy-4-[5-[[7-methyl-2,8-bis(oxidanyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]phenoxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
Openeye Name:6-[4-[5-[(2,8-dihydroxy-7-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxy-phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
CAS Name:6-[4-[5-[(2,8-dihydroxy-7-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
IUPAC Name:6-[4-[5-[(2,8-dihydroxy-7-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Traditional Name:6-[4-[5-[(2,8-dihydroxy-7-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-keto-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxy-phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Formula: C35H40O19
MolecularWeight: 764.6807
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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2C(COC(O2)O)OC1OC3C4COC(=O)C4C(C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OC8C(C(C(C(O8)C(=O)O)O)O)O)OC)O


Isomeric SMILES

CC1C(C2C(COC(O2)O)OC1OC3C4COC(=O)C4C(C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OC8C(C(C(C(O8)C(=O)O)O)O)O)OC)O


InChI

InChI=1S/C35H40O19/c1-11-23(36)29-20(9-47-35(43)54-29)50-33(11)51-27-14-7-17-16(48-10-49-17)6-13(14)21(22-15(27)8-46-32(22)42)12-4-18(44-2)28(19(5-12)45-3)52-34-26(39)24(37)25(38)30(53-34)31(40)41/h4-7,11,15,20-27,29-30,33-39,43H,8-10H2,1-3H3,(H,40,41)


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