[(2R,3R)-2-[3,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl] 6-[3,4,5-tris(oxidanyl)phenyl]hexanoate

Systemtic Name: [(2R,3R)-2-[3,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-3-yl] 6-[3,4,5-tris(oxidanyl)phenyl]hexanoate Openeye Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chroman-3-yl] 6-(3,4,5-trihydroxyphenyl)hexanoate CAS Name: 6-(3,4,5-trihydroxyphenyl)hexanoic acid [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 6-(3,4,5-trihydroxyphenyl)hexanoate Traditional Name: 6-(3,4,5-trihydroxyphenyl)hexanoic acid [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chroman-3-yl] ester Formula: C27H28O10 MolecularWeight: 512.50522

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)CCCCCC4=CC(=C(C(=C4)O)O)O

Isomeric SMILES

C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)CCCCCC4=CC(=C(C(=C4)O)O)O

InChI

InChI=1S/C27H28O10/c28-16-11-19(30)17-13-24(27(37-23(17)12-16)15-6-7-18(29)20(31)10-15)36-25(34)5-3-1-2-4-14-8-21(32)26(35)22(33)9-14/h6-12,24,27-33,35H,1-5,13H2/t24-,27-/m1/s1