| SpectraBase Spectrum ID |
621A6Py2PPp |
| Name |
(2S)-1-O-.beta.-D-Dlucopyranosyl-2-O-caffeoylglycerol peracetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H38O18 |
| InChI |
InChI=1S/C32H38O18/c1-16(33)41-13-24(49-28(40)11-9-23-8-10-25(44-18(3)35)26(12-23)45-19(4)36)14-43-32-31(48-22(7)39)30(47-21(6)38)29(46-20(5)37)27(50-32)15-42-17(2)34/h8-12,24,27,29-32H,13-15H2,1-7H3/b11-9+/t24?,27-,29-,30+,31-,32-/m1/s1 |
| InChIKey |
ZPOUFABXJRQTAR-CREWMANNSA-N |
| Molecular Weight |
710.638 g/mol |
| SMILES |
[C@@]1([C@]([C@](OCC(OC(\C=C\c2cc(OC(=O)C)c(cc2)OC(=O)C)=O)COC(=O)C)(O[C@@]([C@]1(OC(=O)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H] |
| SPLASH |
splash10-066r-0912000000-aa4defab59f5e2b187fe |
| Source of Spectrum |
E1-39-2368-20 |
| Wiley ID |
1519083 |
