[4,6′:8′,4′′-Ter-2H-1-benzopyran]-3,3′,3′′,5′,7,7′,7′′-heptol, 2,2′,2′′-tris(3,4-dihydroxyphenyl)-3,3′,3′′,4,4′,4′′-hexahydro-, [2′′S-[2′′α,3′′β,4′′α[2′S*,3′R*,6′(2R*,3S*,4S*)]]]-

CAS Registry Number®

88269-47-0

CAS Name

[4,6′:8′,4′′-Ter-2H-1-benzopyran]-3,3′,3′′,5′,7,7′,7′′-heptol, 2,2′,2′′-tris(3,4-dihydroxyphenyl)-3,3′,3′′,4,4′,4′′-hexahydro-, [2′′S-[2′′α,3′′β,4′′α[2′S*,3′R*,6′(2R*,3S*,4S*)]]]-

Molecular Formula

C45H38O16

Molecular Mass

834.77

Cite this Page

[4,6′:8′,4′′-Ter-2H-1-benzopyran]-3,3′,3′′,5′,7,7′,7′′-heptol, 2,2′,2′′-tris(3,4-dihydroxyphenyl)-3,3′,3′′,4,4′,4′′-hexahydro-, [2′′S-[2′′α,3′′β,4′′α[2′S*,3′R*,6′(2R*,3S*,4S*)]]]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88269-47-0 (retrieved 2024-11-13) (CAS RN: 88269-47-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C45H38O16/c46-20-4-6-22-32(14-20)59-43(18-2-9-26(49)29(52)12-18)40(57)34(22)36-38(55)24-16-31(54)42(17-1-8-25(48)28(51)11-17)61-45(24)37(39(36)56)35-23-7-5-21(47)15-33(23)60-44(41(35)58)19-3-10-27(50)30(53)13-19/h1-15,31,34-35,40-44,46-58H,16H2/t31-,34+,35+,40+,41+,42+,43-,44-/m0/s1

InChIKey

InChIKey=VYURQCQMACPHRC-KTJYOBIESA-N

SMILES

OC=1C(=C2C(=C(O)C1[C@H]3C=4C(O[C@H]([C@@H]3O)C5=CC(O)=C(O)C=C5)=CC(O)=CC4)C[C@H](O)[C@H](O2)C6=CC(O)=C(O)C=C6)[C@H]7C=8C(O[C@H]([C@@H]7O)C9=CC(O)=C(O)C=C9)=CC(O)=CC8

Canonical SMILES

OC1=CC=C2C(OC(C3=CC=C(O)C(O)=C3)C(O)C2C4=C(O)C5=C(OC(C6=CC=C(O)C(O)=C6)C(O)C5)C(=C4O)C7C8=CC=C(O)C=C8OC(C9=CC=C(O)C(O)=C9)C7O)=C1

Other Names for this Substance

  • [4,6′:8′,4′′-Ter-2H-1-benzopyran]-3,3′,3′′,5′,7,7′,7′′-heptol, 2,2′,2′′-tris(3,4-dihydroxyphenyl)-3,3′,3′′,4,4′,4′′-hexahydro-, [2′′S-[2′′α,3′′β,4′′α[2′S*,3′R*,6′(2R*,3S*,4S*)]]]-

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles