(2S,3S,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3R,4S,5R,6R)-2-methyl-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-5-[2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-3-yl]oxy-6-methyl-oxane-3,4-dicarbaldehyde

Systemtic Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3R,4S,5R,6R)-2-methyl-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-5-[2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-3-yl]oxy-6-methyl-oxane-3,4-dicarbaldehyde Openeye Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4S,5R,6R)-4,5,6-trihydroxy-2-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-5-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-chromen-3-yl]oxy-6-methyl-tetrahydropyran-3,4-dicarbaldehyde CAS Name: (2S,3S,4S,5S,6R)-2-[[(2R,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[[(2R,3R,4S,5R,6R)-4,5,6-trihydroxy-2-methyl-3-oxanyl]oxy]-3-oxanyl]oxy]-5-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-1-benzopyran-3-yl]oxy]-6-methyloxane-3,4-dicarboxaldehyde IUPAC Name: (2S,3S,4S,5S,6R)-2-[(2R,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3R,4S,5R,6R)-4,5,6-trihydroxy-2-methyloxan-3-yl]oxyoxan-3-yl]oxy-5-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-6-methyloxane-3,4-dicarbaldehyde Traditional Name: (2S,3S,4S,5S,6R)-5-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-keto-chromen-3-yl]oxy-2-[(2R,3S,4S,5R,6S)-4,5-dihydroxy-2-methylol-6-[(2R,3R,4S,5R,6R)-4,5,6-trihydroxy-2-methyl-tetrahydropyran-3-yl]oxy-tetrahydropyran-3-yl]oxy-6-methyl-tetrahydropyran-3,4-dicarbaldehyde Formula: C35H40O19 MolecularWeight: 764.6807

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)O)O)O)OC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)C)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)C=O)C=O)O)O

Isomeric SMILES

C[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O)O)O)O[C@H]2[C@@H]([C@@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@@H]([C@@H]([C@H](O3)C)OC4=C(OC5=CC(=CC(=C5C4=O)O)O)C6=CC=C(C=C6)O)C=O)C=O)O)O

InChI

InChI=1S/C35H40O19/c1-12-28(52-32-23(42)22-19(41)7-16(40)8-20(22)50-30(32)14-3-5-15(39)6-4-14)17(9-36)18(10-37)34(49-12)54-31-21(11-38)51-35(27(46)25(31)44)53-29-13(2)48-33(47)26(45)24(29)43/h3-10,12-13,17-18,21,24-29,31,33-35,38-41,43-47H,11H2,1-2H3/t12-,13-,17+,18-,21-,24+,25+,26-,27-,28-,29+,31-,33-,34+,35+/m1/s1