Drug Information

Drug General Information

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Drug ID

D06YGF

Former ID

DNC000379

Drug Name

Caffeic acid phenethyl ester

Synonyms

Caffeic acid phenethyl ester; Phenethyl caffeate; 104594-70-9; CAPE; phenethyl 3-(3,4-dihydroxyphenyl)acrylate; Capeee; Phenylethyl caffeate; 115610-29-2; caffeic acid phenylethyl ester; UNII-G960R9S5SK; 2-phenylethyl caffeate; PHENETHYL CAFFEATE (CAPE); Caffeic acid-phenethyl ester; CHEBI:8062; G960R9S5SK; CHEMBL319244; 100981-80-4; Caffeic acid 2-phenylethyl ester; SWUARLUWKZWEBQ-VQHVLOKHSA-N; 2-phenylethyl 3-(3,4-dihydroxyphenyl)-2-propenoate; Caffeic Acid Phenethyl Ester, Synthetic; 2-Phenylethyl (2e)-3-(3,4-Dihydroxyphenyl

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Drug Type

Small molecular drug

Indication

Discovery agent [ICD-11: N.A.]

Investigative

[1]

Structure

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2D MOL

3D MOL

Formula

C17H16O4

Canonical SMILES

C1=CC=C(C=C1)CCOC(=O)C=CC2=CC(=C(C=C2)O)O

InChI

1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+

InChIKey

SWUARLUWKZWEBQ-VQHVLOKHSA-N

CAS Number

CAS 115610-29-2

PubChem Compound ID

5281787

PubChem Substance ID

12667, 612314, 8616777, 12015124, 12016057, 14848879, 17404832, 24278341, 26612332, 26680006, 26747475, 26747476, 26753537, 26758378, 39315396, 46500450, 47274169, 47498112, 47498113, 47572002, 47572003, 49747045, 50024592, 50106023, 50106024, 50106025, 50106026, 50106027, 53777375, 53789035, 57358384, 76101379, 80954258, 85787755, 85789112, 85789433, 90341501, 91010615, 92303625, 92309976, 93576740, 93617082, 99300888, 99302408, 103323115, 103938278, 113855929, 118842495, 121360924, 124637378

ChEBI ID

CHEBI:8062

Target and Pathway

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Target(s)

Nuclear factor NF-kappa-B (NFKB)

Target Info

Inhibitor

[1]

KEGG Pathway

MAPK signaling pathway

NF-kappa B signaling pathway