Dataset
![molecular Image]()
trans-Cinnamic acid
Chemical Info
| InChI | InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+ |
|---|---|
| SMILES | OC(=O)\C=C\C1=CC=CC=C1 |
| InChI Key | WBYWAXJHAXSJNI-VOTSOKGWSA-N |
| Molecular Formula | C9H8O2 |
| Exact Mass | 148.052 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N109828_B8BB |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T09:31:06.764752 |
| MetadataModified | 2024-01-11T09:31:06.944032 |
| MetadataPublished | 2022-04-09 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| ZINC000016051516 | ZINC |
| 16430 | BindingDB |
| CB84796866 | ChemicalBook |
| CINNAMIC ACID PREPARATION | rxnorm |
| DTXSID5022489 | EPA CompTox Dashboard |
| MCULE-1077406303 | Mcule |
| HY-N0610A | MedChemExpress |
| 74505 | Brenda |
| MTBLC35697 | Metabolights |
| CB0345387 | ChemicalBook |
| CB7345386 | ChemicalBook |
| HMDB0000930 | Human Metabolome Database |
| 90307 | Brenda |
| 6144 | Brenda |
| 1544 | Brenda |
| 49566 | Brenda |
| 3497 | Brenda |
| 165124 | Brenda |
| 15219201 | PubChem: Thomson Pharma |
| 444539 | PubChem |
| 260000 | Brenda |
| PD002063 | ProbesDrugs |
| 1823 | Brenda |
| U14A832J8D | FDA SRS |
| 140-10-3 | ACToR |
| 621-82-9 | ACToR |
| 864 | Brenda |
| SCHEMBL1332 | SureChEMBL |
| CINMAC | CCDC |
| DB18313 | DrugBank |
| J2.024I | Nikkaji |
| 35697 | ChEBI |
| J2.087G | Nikkaji |
| 3203 | Guide to Pharmacology |
| 10113810 | NMRShiftDB |
| TCA | PDBe |
| CHEMBL27246 | ChEMBL |
| C00423 | KEGG Ligand |
| C10438 | KEGG Ligand |
| 480106 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |