caffeic acid phenethyl ester (Q15410860)

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chemical compound
  • Caffeic acid phenethyl ester
  • CAPE
  • 2-phenylethyl caffeate
  • phenethyl caffeate
  • 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate
  • (E)-caffeic acid phenethyl ester
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Language Label Description Also known as
English
caffeic acid phenethyl ester
chemical compound
  • Caffeic acid phenethyl ester
  • CAPE
  • 2-phenylethyl caffeate
  • phenethyl caffeate
  • 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate
  • (E)-caffeic acid phenethyl ester

Statements

chemical structure
Phenethyl caffeate.svg
512 × 173; 17 KB
0 references
mass
284.105 dalton
1 reference
stated in
PubChem
PubChem CID
5281787
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 October 2016
chemical formula
C₁₇H₁₆O₄
1 reference
stated in
PubChem
PubChem CID
5281787
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 November 2016
canonical SMILES
C1=CC=C(C=C1)CCOC(=O)C=CC2=CC(=C(C=C2)O)O
1 reference
stated in
PubChem
PubChem CID
5281787
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 November 2016
isomeric SMILES
C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O
1 reference
stated in
PubChem
PubChem CID
5281787
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 November 2016

Identifiers

ChemSpider ID
4445100
1 reference
stated in
ChemSpider
ChemSpider ID
4445100
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 November 2016
PubChem CID
5281787
1 reference
stated in
PubChem
PubChem CID
5281787
language of work or name
English
title
Caffeic acid phenethyl ester (English)
retrieved
19 November 2016
Reaxys registry number
4752508
1 reference
stated in
ChEBI
ChEBI ID
8062
language of work or name
English
title
phenethyl caffeate (English)
retrieved
19 October 2016
ChEMBL ID
CHEMBL319244
1 reference
stated in
ChEMBL
ChEMBL ID
CHEMBL319244
language of work or name
English
title
CAFFEIC ACID PHENETHYL ESTER (English)
retrieved
19 November 2016
EC number
627-151-0
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.155.538
retrieved
27 December 2018
title
(E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid, 2-phenylethyl ester (English)
quotation
CAS no.: 104594-70-9 (English)
ECHA Substance Infocard ID
100.155.538
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.155.538
retrieved
27 December 2018
title
(E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid, 2-phenylethyl ester (English)
quotation
CAS no.: 104594-70-9 (English)
UNII
G960R9S5SK
1 reference
stated in
Global Substance Registration System
UNII
G960R9S5SK
language of work or name
English
title
caffeic acid phenethyl ester (English)
retrieved
19 November 2016
KEGG ID
C10484
1 reference
stated in
ChEBI
ChEBI ID
8062
language of work or name
English
title
phenethyl caffeate (English)
retrieved
19 October 2016
PDB ligand ID
QAP
0 references
Freebase ID
/m/0jt2wls
0 references
 
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