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caffeoylglycolic acid methyl ester
A cinnamate ester obtained by the condensation of trans-caffeic acid with methyl hydroxyacetate. It is isolated from the leaves of Parthenocissus tricuspidata and exhibits antioxidant activity.


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03. Biological Effects of Specific Chemicals: biochemical uses [CHEBI:52206] > metabolite [CHEBI:25212] > secondary metabolite [CHEBI:26619] > caffeoylglycolic acid methyl ester [CHEBI:65548]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 biochemical uses [CHEBI:52206] (3306) 
 metabolite [CHEBI:25212] (2692) 
 secondary metabolite [CHEBI:26619] (2225) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
06. Name of Biological Source of Chemical 
06. Name of Biological Source of Chemical
 Plantae (1926) 
 Magnoliophyta (1872) 
 Magnoliopsida (1649) 
 Vitales (2) 
 Vitaceae (2) 
 Parthenocissus (1) 
 Parthenocissus tricuspidata (1)
07. Part of Biological Source of Chemical 
07. Part of Biological Source of Chemical
 plant structure [PO:0009011] (1497) 
 multi-tissue plant structure [PO:0025496] (1114) 
 plant organ [PO:0009008] (970) 
 phyllome [PO:0006001] (351) 
 leaf [PO:0025034] (351)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 s-block molecular entity [CHEBI:33674] (7287) 
 hydrogen molecular entity [CHEBI:33608] (6932) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 p-block molecular entity [CHEBI:33675] (25343) 
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic hydroxy compound [CHEBI:33822] (3050) 
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 ester [CHEBI:35701] (3370) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic aromatic compound [CHEBI:33659] (3593) 
 phenylpropanoid [CHEBI:26004] (374) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic oxo compound [CHEBI:36587] (5932) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 molecule [CHEBI:25367] (11520) 
 cyclic compound [CHEBI:33595] (7817) 
 aromatic compound [CHEBI:33655] (3799) 
 organic aromatic compound [CHEBI:33659] (3593) 
 phenylpropanoid [CHEBI:26004] (374) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic cyclic compound [CHEBI:33832] (7633) 
 organic aromatic compound [CHEBI:33659] (3593) 
 phenylpropanoid [CHEBI:26004] (374) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic aromatic compound [CHEBI:33659] (3593) 
 phenylpropanoid [CHEBI:26004] (374) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 organic oxo compound [CHEBI:36587] (5932) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 alpha,beta-unsaturated carboxylic ester [CHEBI:51737] (68) 
 enoate ester [CHEBI:51702] (65) 
 cinnamate ester [CHEBI:36087] (36) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
 heteroatomic molecular entity [CHEBI:37577] (13672) 
 hydroxides [CHEBI:24651] (5641) 
 organic hydroxy compound [CHEBI:33822] (3050) 
 phenols [CHEBI:33853] (868) 
 benzenediols [CHEBI:33570] (188) 
 catechols [CHEBI:33566] (97) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
09. Chemical Capabilities 
09. Chemical Capabilities
 antioxidant [CHEBI:22586] (199) 
 radical scavenger [CHEBI:48578] (62) 
 caffeoylglycolic acid methyl ester [CHEBI:65548] (1)
ChEBI Compound Accession Identifier  [CHEBI:65548]
ChEBI Compound Description  A cinnamate ester obtained by the condensation of trans-caffeic acid with methyl hydroxyacetate. It is isolated from the leaves of Parthenocissus tricuspidata and exhibits antioxidant activity.
ChEBI Compound Identification Number  65548
ChEBI InChI Value  InChI=1S/C12H12O6/c1-17-12(16)7-18-11(15)5-3-8-2-4-9(13)10(14)6-8/h2-6,13-14H,7H2,1H3/b5-3+
ChEBI InChIKey Value  BTLDPXVDOAPOIR-HWKANZROSA-N
ChEBI Compound Name  caffeoylglycolic acid methyl ester
ChEBI SMILES Value  COC(=O)COC(=O)\C=C\c1ccc(O)c(O)c1
ChEBI Substance ID  160655763
ChEBI URL  ChEBI:65548
ChemSpider ID  28532940
Ontomatica Chemical Accession Key (OnChAKey)  BTLDPXVDOAPOIR_HWKANZROSA_N_000_000000
PubChem Compound ID  23659586