β-D-Glucopyranoside, 3-hydroxy-5-[(2S,2′R,3S,3′R)-2,2′,3,3′-tetrahydro-6,6′-dihydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-3′-yl]phenyl
CAS Registry Number®
168010-10-4
CAS Name
β-D-Glucopyranoside, 3-hydroxy-5-[(2S,2′R,3S,3′R)-2,2′,3,3′-tetrahydro-6,6′-dihydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-3′-yl]phenylMolecular Formula
C48H42O14Molecular Mass
842.84Cite this Page
β-D-Glucopyranoside, 3-hydroxy-5-[(2S,2′R,3S,3′R)-2,2′,3,3′-tetrahydro-6,6′-dihydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-3′-yl]phenyl. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=168010-10-4 (retrieved ) (CAS RN: 168010-10-4). 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)59-34-17-27(16-31(53)18-34)40-41-35(19-33(55)21-37(41)61-46(40)24-5-11-29(51)12-6-24)42-39-26(4-1-23-2-9-28(50)10-3-23)15-32(54)20-36(39)60-47(42)25-7-13-30(52)14-8-25/h1-21,38,40,42-58H,22H2
InChIKey
InChIKey=SZKVNSODIJRAET-UHFFFAOYSA-N
SMILES
C(=CC1=CC=C(O)C=C1)C2=C3C(C(OC3=CC(O)=C2)C4=CC=C(O)C=C4)C5=C6C(C(OC6=CC(O)=C5)C7=CC=C(O)C=C7)C8=CC(OC9OC(CO)C(O)C(O)C9O)=CC(O)=C8
Canonical SMILES
OC1=CC=C(C=C1)C=CC=2C=C(O)C=C3OC(C4=CC=C(O)C=C4)C(C=5C=C(O)C=C6OC(C7=CC=C(O)C=C7)C(C=8C=C(O)C=C(OC9OC(CO)C(O)C(O)C9O)C8)C65)C32
Other Names for this Substance
- β-D-Glucopyranoside, 3-hydroxy-5-[(2S,2′R,3S,3′R)-2,2′,3,3′-tetrahydro-6,6′-dihydroxy-2,2′-bis(4-hydroxyphenyl)-4-[(1Z)-2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-3′-yl]phenyl
- β-D-Glucopyranoside, 3-hydroxy-5-[2,2′,3,3′-tetrahydro-6,6′-dihydroxy-2,2′-bis(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl][3,4′-bibenzofuran]-3′-yl]phenyl, [2S-[2α,3β(2′S*,3′S*),4(Z)]]-
- Foeniculoside I
