Synonym
Caffeoylglycolic acid;
IUPAC/Chemical Name
(E)-2-((3-(3,4-dihydroxyphenyl)acryloyl)oxy)acetic acid
InChi Key
HGZGMSVCFBWKLH-DUXPYHPUSA-N
InChi Code
InChI=1S/C11H10O6/c12-8-3-1-7(5-9(8)13)2-4-11(16)17-6-10(14)15/h1-5,12-13H,6H2,(H,14,15)/b4-2+
SMILES Code
OC(COC(/C=C/c1cc(O)c(O)cc1)=O)=O
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
Preparing Stock Solutions
The following data is based on the
product
molecular weight
238.20
Batch specific molecular weights may vary
from batch to batch
due to the degree of hydration, which will
affect the solvent
volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass |
1 mg |
5 mg |
10 mg |
| 1 mM |
1.15 mL |
5.76 mL |
11.51 mL |
| 5 mM |
0.23 mL |
1.15 mL |
2.3 mL |
| 10 mM |
0.12 mL |
0.58 mL |
1.15 mL |
| 50 mM |
0.02 mL |
0.12 mL |
0.23 mL |
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2: Lee SU, Shin CG, Lee CK, Lee YS. Caffeoylglycolic and caffeoylamino acid derivatives, halfmers of L-chicoric acid, as new HIV-1 integrase inhibitors. Eur J Med Chem. 2007 Oct;42(10):1309-15. doi: 10.1016/j.ejmech.2007.02.016. Epub 2007 Mar 12. PMID: 17434650.
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4: Saleem M, Kim HJ, Jin C, Lee YS. Antioxidant caffeic acid derivatives from leaves of Parthenocissus tricuspidata. Arch Pharm Res. 2004 Mar;27(3):300-4. doi: 10.1007/BF02980064. PMID: 15089035.
5: Snook ME, Blum MS, Whitman DW, Arrendale RF, Costello CE, Harwood JS. Caffeoyltartronic acid from catnip (Nepeta cataria): A precursor for catechol in lubber grasshopper (Romalea guttata) defensive secretions. J Chem Ecol. 1993 Sep;19(9):1957-66. doi: 10.1007/BF00983799. PMID: 24249371.
6: Kolodyńska Z, Wieniawski W. Otrzymywanie kwasów kafeoiloglikolowych [Synthesis of caffeoylglycolic acids]. Acta Pol Pharm. 1967;24(3):261-5. Polish. PMID: 6055822.
