Dataset
Carteolol
Chemical Info
InChI | InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20) |
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SMILES | OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)NC(=O)C1 |
InChI Key | LWAFSWPYPHEXKX-UHFFFAOYSA-N |
Molecular Formula | C16H24N2O3 |
Exact Mass | 292.179 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | |
License URL | https://creativecommons.org/licenses/by-nc/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001950 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T22:47:00.296467 |
MetadataModified | 2024-01-11T22:47:00.473844 |
MetadataPublished | 2016-01-19 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
HMDB0014662 | Human Metabolome Database |
PA164768736 | PharmGKB |
3437 | ChEBI |
carteolol | DailyMed |
CARTROL | clinicaltrials |
CARTEOLOL HYDROCHLORIDE | clinicaltrials |
CARTEOLOL | clinicaltrials |
OCUPRESS | clinicaltrials |
OPC-1085 | clinicaltrials |
CB0268673 | ChemicalBook |
CARTEOLOL | rxnorm |
OCUPRESS | rxnorm |
CARTEOLOL HYDROCHLORIDE | rxnorm |
CARTEOLOL | DailyMed |
SCHEMBL23721779 | SureChEMBL |
8NF31401XG | FDA SRS |
520 | DrugCentral |
50040065 | BindingDB |
DTXSID3022746 | EPA CompTox Dashboard |
7142 | Guide to Pharmacology |
J13.087G | Nikkaji |
SCHEMBL24810 | SureChEMBL |
2583 | PubChem |
PD009980 | ProbesDrugs |
14849226 | PubChem: Thomson Pharma |
51781-06-7 | ACToR |
LSM-1541 | LINCS |
CHEMBL839 | ChEMBL |
DB00521 | DrugBank |
C06874 | KEGG Ligand |
The data in this table is sourced from UniChem at EBI. |