| SpectraBase Spectrum ID |
G3mjKttNdY6 |
| Name |
[4-Acetyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate, tetraacetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
536.152990949 u |
| Formula |
C25H28O13 |
| InChI |
InChI=1S/C25H28O13/c1-13(26)32-12-20-22(34-15(3)28)23(35-16(4)29)24(25(37-20)36-17(5)30)38-21(31)11-8-18-6-9-19(10-7-18)33-14(2)27/h6-11,20,22-25H,12H2,1-5H3/b11-8+ |
| InChIKey |
LFYBCKXCLFYHLK-DHZHZOJOSA-N |
| Molecular Weight |
536.486 g/mol |
| SMILES |
C1(OC(=O)C)C(C(C(OC(=O)C)C(COC(=O)C)O1)OC(C)=O)OC(=O)\C=C\C=1C=CC(OC(=O)C)=CC1 |
![[4-Acetyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate, tetraacetate](/api/spectrum/G3mjKttNdY6/structure.png?h=300&w=458 "[4-Acetyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate, tetraacetate")
