β-D-Glucopyranoside, 4-hydroxyphenyl, 6-[(2E)-3-(1,4-dihydroxy-6-oxo-2-cyclohexen-1-yl)-2-propenoate]
CAS Registry Number®
1262142-66-4
CAS Name
β-D-Glucopyranoside, 4-hydroxyphenyl, 6-[(2E)-3-(1,4-dihydroxy-6-oxo-2-cyclohexen-1-yl)-2-propenoate]Molecular Formula
C21H24O11Molecular Mass
452.41Cite this Page
β-D-Glucopyranoside, 4-hydroxyphenyl, 6-[(2E)-3-(1,4-dihydroxy-6-oxo-2-cyclohexen-1-yl)-2-propenoate]. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1262142-66-4 (retrieved ) (CAS RN: 1262142-66-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H24O11/c22-11-1-3-13(4-2-11)31-20-19(28)18(27)17(26)14(32-20)10-30-16(25)6-8-21(29)7-5-12(23)9-15(21)24/h1-8,12,14,17-20,22-23,26-29H,9-10H2/b8-6+/t12?,14-,17-,18+,19-,20-,21?/m1/s1
InChIKey
InChIKey=MJKRDLMPYUENAA-OANOARFOSA-N
SMILES
O([C@@H]1O[C@H](COC(/C=C/C2(O)C(=O)CC(O)C=C2)=O)[C@@H](O)[C@H](O)[C@H]1O)C3=CC=C(O)C=C3
Canonical SMILES
O=C(OCC1OC(OC2=CC=C(O)C=C2)C(O)C(O)C1O)C=CC3(O)C=CC(O)CC3=O
Other Names for this Substance
- β-D-Glucopyranoside, 4-hydroxyphenyl, 6-[(2E)-3-(1,4-dihydroxy-6-oxo-2-cyclohexen-1-yl)-2-propenoate]
- Robustaside E