| SpectraBase Spectrum ID |
uGaLC2knKz |
| Name |
.beta.-D-Glucopyranoside, 4-(acetyloxy)phenyl, 2,3,4-triacetate 6-[3-[3,4-bis(acetyloxy)phenyl]-2-propenoate] |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
686.184684999 u |
| Formula |
C33H34O16 |
| InChI |
InChI=1S/C33H34O16/c1-17(34)42-24-9-11-25(12-10-24)48-33-32(47-22(6)39)31(46-21(5)38)30(45-20(4)37)28(49-33)16-41-29(40)14-8-23-7-13-26(43-18(2)35)27(15-23)44-19(3)36/h7-15,28,30-33H,16H2,1-6H3/b14-8+ |
| InChIKey |
FCBYKQKJYMBMGR-RIYZIHGNSA-N |
| Molecular Weight |
686.619 g/mol |
| SMILES |
C(O[C@@]1([C@@](OC(C)=O)([C@](OC2=CC=C(C=C2)OC(C)=O)(O[C@@]([C@]1(OC(C)=O)[H])(COC(\C=C\C1=CC(OC(C)=O)=C(C=C1)OC(C)=O)=O)[H])[H])[H])[H])(C)=O |
![.beta.-D-Glucopyranoside, 4-(acetyloxy)phenyl, 2,3,4-triacetate 6-[3-[3,4-bis(acetyloxy)phenyl]-2-propenoate]](/api/spectrum/uGaLC2knKz/structure.png?h=300&w=458 ".beta.-D-Glucopyranoside, 4-(acetyloxy)phenyl, 2,3,4-triacetate 6-[3-[3,4-bis(acetyloxy)phenyl]-2-propenoate]")
