| SpectraBase Spectrum ID |
HCNYOFrIXdE |
| Name |
Rosmarinic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16O8 |
| InChI |
InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1 |
| InChIKey |
DOUMFZQKYFQNTF-WUTVXBCWSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np010636j |
| Molecular Weight |
360.318 g/mol |
| Optical Rotation |
[a]D22 = +81.6 (c = 0.41, MeOH) |
| SMILES |
Oc1ccc(C[C@@](OC(\C=C\c2cc(c(cc2)O)O)=O)(C(O)=O)[H])cc1O |
| SPLASH |
splash10-00fr-0900000000-f6a072949a306a5efa32 |
| Source of Spectrum |
G4-65-896-1 |
| Wiley ID |
1883720 |
