Dataset
Kojic acid
Chemical Info
InChI | InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2 |
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SMILES | C1=C(OC=C(C1=O)O)CO |
InChI Key | BEJNERDRQOWKJM-UHFFFAOYSA-N |
Molecular Formula | C6H6O4 |
Exact Mass | 142.027 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81542 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T22:28:22.481534 |
MetadataModified | 2024-01-11T22:28:22.635508 |
MetadataPublished | 2016-01-19 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
KOJ | PDBe |
C14516 | KEGG Ligand |
DB01759 | DrugBank |
CHEMBL287556 | ChEMBL |
524639 | eMolecules |
43572 | ChEBI |
J1.564D | Nikkaji |
20182546 | NMRShiftDB |
MCULE-1079267668 | Mcule |
PD001182 | ProbesDrugs |
6K23F1TT52 | FDA SRS |
123712-78-7 | ACToR |
3840 | PubChem |
SCHEMBL36895 | SureChEMBL |
16080921 | PubChem: Thomson Pharma |
501-30-4 | ACToR |
HMDB0032923 | Human Metabolome Database |
CB7272507 | ChemicalBook |
MTBLC43572 | Metabolights |
19357 | Brenda |
566 | Brenda |
28999 | Brenda |
3977 | DrugCentral |
ZZZFMU | CCDC |
DTXSID2040236 | EPA CompTox Dashboard |
ZINC000013831818 | ZINC |
KOJIC ACID | rxnorm |
50031467 | BindingDB |
HY-W050154 | MedChemExpress |
The data in this table is sourced from UniChem at EBI. |