Dataset
2-Hydroxyanthraquinone
Chemical Info
InChI | InChI=1S/C14H8O3/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7,15H |
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SMILES | c1ccc2c(c1)C(=O)c1c(C2=O)cc(cc1)O |
InChI Key | GCDBEYOJCZLKMC-UHFFFAOYSA-N |
Molecular Formula | C14H8O3 |
Exact Mass | 224.047 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UA002402 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T21:51:53.112263 |
MetadataModified | 2025-02-09T19:45:53.195169 |
MetadataPublished | 2014-06-24 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
DTXSID4049327 | EPA CompTox Dashboard |
50025601 | BindingDB |
KAVBAL | CCDC |
J62.267B | Nikkaji |
CB8695507 | ChemicalBook |
37482 | ChEBI |
CHEMBL446963 | ChEMBL |
15196043 | PubChem: Thomson Pharma |
11796 | PubChem |
605-32-3 | ACToR |
27938-76-7 | ACToR |
PD151278 | ProbesDrugs |
929569 | eMolecules |
30100967 | NMRShiftDB |
MCULE-1316158292 | Mcule |
SCHEMBL498619 | SureChEMBL |
ZINC000003896782 | ZINC |
91054 | Brenda |
2R8351U6Q0 | FDA SRS |
The data in this table is sourced from UniChem at EBI. |