β-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl, 2-(3,4-dihydroxybenzeneacetate)
CAS Registry Number®
914649-31-3
CAS Name
β-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl, 2-(3,4-dihydroxybenzeneacetate)Molecular Formula
C22H26O10Molecular Mass
450.44Cite this Page
β-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl, 2-(3,4-dihydroxybenzeneacetate). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=914649-31-3 (retrieved ) (CAS RN: 914649-31-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H26O10/c23-11-17-19(28)20(29)21(32-18(27)10-13-3-6-15(25)16(26)9-13)22(31-17)30-8-7-12-1-4-14(24)5-2-12/h1-6,9,17,19-26,28-29H,7-8,10-11H2/t17-,19-,20+,21-,22-/m1/s1
InChIKey
InChIKey=KCKBTWNNYSDHSE-MIUGBVLSSA-N
SMILES
O(C(CC1=CC(O)=C(O)C=C1)=O)[C@H]2[C@H](OCCC3=CC=C(O)C=C3)O[C@H](CO)[C@@H](O)[C@@H]2O
Canonical SMILES
O=C(OC1C(OCCC2=CC=C(O)C=C2)OC(CO)C(O)C1O)CC3=CC=C(O)C(O)=C3
Other Names for this Substance
- β-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl, 2-(3,4-dihydroxybenzeneacetate)
- Ternstroside E