[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
C36H36O17Molecular Mass
740.66Cite 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 ) (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