[4,8′-Bi-2H-1-benzopyran]-3,3′,5,5′,7,7′-hexol, 2,2′-bis(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-3,3′,4,4′-tetrahydro-, [2R-[2α,3α,4β(2′R*,3′R)]]-

CAS Registry Number®

103215-59-4

CAS Name

[4,8′-Bi-2H-1-benzopyran]-3,3′,5,5′,7,7′-hexol, 2,2′-bis(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-3,3′,4,4′-tetrahydro-, [2R-[2α,3α,4β(2′R*,3′R)]]-

Molecular Formula

C36H36O17

Molecular Mass

740.66

Cite this Page

[4,8′-Bi-2H-1-benzopyran]-3,3′,5,5′,7,7′-hexol, 2,2′-bis(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-3,3′,4,4′-tetrahydro-, [2R-[2α,3α,4β(2′R*,3′R)]]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103215-59-4 (retrieved 2024-11-05) (CAS RN: 103215-59-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H36O17/c37-10-23-28(46)31(49)32(50)36(52-23)25-20(44)9-22-26(29(25)47)27(30(48)34(51-22)12-2-4-15(39)18(42)6-12)24-19(43)8-16(40)13-7-21(45)33(53-35(13)24)11-1-3-14(38)17(41)5-11/h1-6,8-9,21,23,27-28,30-34,36-50H,7,10H2/t21-,23-,27+,28-,30-,31+,32-,33-,34-,36+/m1/s1

InChIKey

InChIKey=VRCSTDIDMJHJBX-UYLIQQMISA-N

SMILES

O[C@@H]1[C@H](C=2C(O[C@@H]1C3=CC(O)=C(O)C=C3)=CC(O)=C(C2O)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C5=C6C(C[C@@H](O)[C@H](O6)C7=CC(O)=C(O)C=C7)=C(O)C=C5O

Canonical SMILES

OC1=CC=C(C=C1O)C2OC=3C(=C(O)C=C(O)C3C4C5=C(O)C(=C(O)C=C5OC(C6=CC=C(O)C(O)=C6)C4O)C7OC(CO)C(O)C(O)C7O)CC2O

Other Names for this Substance

  • [4,8′-Bi-2H-1-benzopyran]-3,3′,5,5′,7,7′-hexol, 2,2′-bis(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-3,3′,4,4′-tetrahydro-, [2R-[2α,3α,4β(2′R*,3′R)]]-

Deleted or Replaced CAS Registry Numbers

105330-50-5

CAS INSIGHTSTM
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