Rosmarinic acid
Compound with spectra: 6 NMR, 2 FTIR, and 2 MS (GC)
| SpectraBase Compound ID | 3Fsktxi4mIZ |
|---|---|
| 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 |
| Mol Weight | 360.32 g/mol |
| Molecular Formula | C18H16O8 |
| Exact Mass | 360.084517 g/mol |
| Enantiomer InChIKey | DOUMFZQKYFQNTF-GIZXNFQBSA-N |
| Racemate InChIKey | DOUMFZQKYFQNTF-ZZXKWVIFSA-N |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Enzo Life Sciences |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 270-253-M010 |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Catalog Number | 536954 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | SCS-25-SM5-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | G4-65-896-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
- (R)-O-(3,4-Dihydroxycinnamoyl)-3-(3,4- dihydroxyphenyl)lactic acid
- 3,4-Dihydroxycinnamic acid (R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethyl ester
3-O-CAFFEOYL-2-C-METHYL-D-ERYTHRONO-1,4-LACTONE
Methyl 2-(acetyloxy)-3-(3-hydroxy-4-[(E)-phenyldiazenyl]phenyl)propanoate
3-[3,4-(ISOPROPYLIDENEDIOXY)PHENYL]LACTIC ACID
3-(3,4-Isopropylidenedioxy-phenyl)-lactic acid, anion
Glycerol <1-acetyl-3-caffeoyl->, tri-TMS
Methyl 3-{4'-methoxy-3'-[4"-(3-methoxy-3-oxopropyl)phenoxy]phenyl}-acrylate
Glycerol <2-acetyl-1,3-dicaffeoyl->, tetra-TMS
Glycerol <1,2-diacetyl-3-caffeoyl->, di-TMS
| Title | Journal or Book | Year |
|---|---|---|
| Structural characterisation and antioxidant activity evaluation of phenolic compounds from cold-pressed Perilla frutescens var. arguta seed flour | Food Chemistry | 2014 |
| HPLC/DAD determination of rosmarinic acid in Salvia officinalis: sample preparation optimization by factorial design | Journal of the Brazilian Chemical Society | 2013 |
| Rosmarinic acid, a new snake venom phospholipase A2 inhibitor from Cordia verbenacea (Boraginaceae): antiserum action potentiation and molecular interaction | Toxicon | 2005 |
| Studies on Jamu and the medicinal resources in Indonesia. Part 2. Studies on the Constituents of Fruits of Helicteres isora L. | Chemical and Pharmaceutical Bulletin | 1999 |
| Constituents of Roots of Salvia deserta SCHANG. (Xinjiang-Danshen). | Chemical and Pharmaceutical Bulletin | 1998 |
| Structure of a new antioxidative phenolic acid from oregano (Origanum vulgare L.). | Agricultural and Biological Chemistry | 1989 |
NIST/EPA/NIH MS/MS Mass Spectral Library 2020 LR
Author: NIST
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.
NIST/EPA/NIH MS/MS Mass Spectral Library 2020 HR
Author: NIST
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.