DHC
CAFFEIC ACID
Find entries where: DHC
is present as a standalone ligand in 13 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries
Chemical Component Summary | |
|---|---|
| Name | CAFFEIC ACID |
| Synonyms | 3,4-DIHYDROXYCINNAMIC ACID |
| Identifiers | (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
| Formula | C9 H8 O4 |
| Molecular Weight | 180.157 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(c(cc1\C=C\C(=O)O)O)O |
| InChI | InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ |
| InChIKey | QAIPRVGONGVQAS-DUXPYHPUSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 21 |
| Chiral Atom Count | 0 |
| Bond Count | 21 |
| Aromatic Bond Count | 6 |
Drug Info: DrugBank
| DrugBank ID | DB01880 |
|---|---|
| Name | 3,4-Dihydroxycinnamic Acid |
| Groups |
|
| Synonyms | 3,4-Dihydroxycinnamic Acid |
| Categories |
|
| CAS number | 331-39-5 |
Drug Targets
| Name | Target Sequence | Pharmacological Action | Actions |
|---|---|---|---|
| Histidine ammonia-lyase | MLAMSPPKPAVELDRHIDLDQAHAVASGGARIVLAPPARDRCRASEARLG... | unknown | |
| Macrophage migration inhibitory factor | MPMFIVNTNVPRASVPDGFLSELTQQLAQATGKPPQYIAVHVVPDQLMAF... | unknown | |
| Photoactive yellow protein | MEHVAFGSEDIENTLAKMDDGQLDGLAFGAIQLDGDGNILQYNAAEGDIT... | unknown |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL145 |
| PubChem | 689043 |
| ChEMBL | CHEMBL145 |
| ChEBI | CHEBI:16433, CHEBI:36281 |
| CCDC/CSD | FESNOG01, UTILIU, FESNOG04, FESNOG02, FESNOG, FOSMIL03, FOSMIL01, FOSMIL, FOSMIL02, FESNOG03, XAGVOU, KAGZOL, ISOJUY |
| COD | 4512025, 4512022 |
