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(2R,2'R,3R,3'R,4R)-2,2'-Bis(3,4-Dihydroxyphenyl)-[4,8'-Bichromane]-3,3',5,5',7,7'-Hexaol

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Catalog Number ACM29106498-1
Product Name (2R,2'R,3R,3'R,4R)-2,2'-Bis(3,4-Dihydroxyphenyl)-[4,8'-Bichromane]-3,3',5,5',7,7'-Hexaol
CAS Number 29106-49-8
Structure (2R,2'R,3R,3'R,4R)-2,2'-Bis(3,4-Dihydroxyphenyl)-[4,8'-Bichromane]-3,3',5,5',7,7'-Hexaol
IUPAC Name (2R,3R)-2-(3,4-dihydroxyphenyl)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
Synonyms Proanthocyanidin B2
Molecular Weight 578.52
Molecular Formula C30H26O12
Canonical SMILES C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
Inchi InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1
InChIKey XFZJEEAOWLFHDH-NFJBMHMQSA-N
Boiling Point 955.3 °C at 760 mmHg
Melting Point 197-198 ºC
Flash Point 531.6±34.3 °C
Purity 97%
Density 1.7±0.1 g/cm3
Refractive Index 1.803

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