β-D-Glucopyranoside, (2S,2′R,3S,3′R)-3′-(3,5-dihydroxyphenyl)-2,2′,3,3′-tetrahydro-6-hydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-6′-yl

CAS Registry Number®

168010-11-5
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CAS Name

β-D-Glucopyranoside, (2S,2′R,3S,3′R)-3′-(3,5-dihydroxyphenyl)-2,2′,3,3′-tetrahydro-6-hydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-6′-yl

Molecular Formula

C48H42O14

Molecular Mass

842.84

Cite this Page

β-D-Glucopyranoside, (2S,2′R,3S,3′R)-3′-(3,5-dihydroxyphenyl)-2,2′,3,3′-tetrahydro-6-hydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-6′-yl.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=168010-11-5 (retrieved 2024-09-20) (CAS RN: 168010-11-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C48H42O14/c49-22-38-43(56)44(57)45(58)48(62-38)59-34-20-35(41-37(21-34)61-46(24-5-11-29(51)12-6-24)40(41)27-16-31(53)18-32(54)17-27)42-39-26(4-1-23-2-9-28(50)10-3-23)15-33(55)19-36(39)60-47(42)25-7-13-30(52)14-8-25/h1-21,38,40,42-58H,22H2

InChIKey

InChIKey=LIMXEMROHIJDBW-UHFFFAOYSA-N

SMILES

O(C1=CC(=C2C(C(OC2=C1)C3=CC=C(O)C=C3)C4=CC(O)=CC(O)=C4)C5C=6C(OC5C7=CC=C(O)C=C7)=CC(O)=CC6C=CC8=CC=C(O)C=C8)C9OC(CO)C(O)C(O)C9O

Canonical SMILES

OC1=CC=C(C=C1)C=CC=2C=C(O)C=C3OC(C4=CC=C(O)C=C4)C(C=5C=C(OC6OC(CO)C(O)C(O)C6O)C=C7OC(C8=CC=C(O)C=C8)C(C=9C=C(O)C=C(O)C9)C75)C32

Other Names for this Substance

  • β-D-Glucopyranoside, (2S,2′R,3S,3′R)-3′-(3,5-dihydroxyphenyl)-2,2′,3,3′-tetrahydro-6-hydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-6′-yl
  • β-D-Glucopyranoside, 3′-(3,5-dihydroxyphenyl)-2,2′,3,3′-tetrahydro-6-hydroxy-2,2′-bis(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-6′-yl, [2S-[2α,3β(2′S*,3′S*),4(Z)]]-
  • Foeniculoside II