Dataset
Doxapram
Chemical Info
InChI | InChI=1S/C24H30N2O2/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22H,2,13-19H2,1H3 |
---|---|
SMILES | C(c(c4)cccc4)(c(c3)cccc3)(C(=O)1)C(CCN(C2)CCOC2)CN(CC)1 |
InChI Key | XFDJYSQDBULQSI-UHFFFAOYSA-N |
Molecular Formula | C24H30N2O2 |
Exact Mass | 378.231 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-WA000831 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T22:50:38.994839 |
MetadataModified | 2024-01-11T22:50:39.172763 |
MetadataPublished | 2016-01-19 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
J5.501H | Nikkaji |
MCULE-9853713128 | Mcule |
SCHEMBL644504 | SureChEMBL |
7169 | Guide to Pharmacology |
DOXAPRAM | DailyMed |
50505297 | BindingDB |
94F3830Q73 | FDA SRS |
HY-B0551 | MedChemExpress |
DOXAPRAM HYDROCHLORIDE | clinicaltrials |
DOCATONE | clinicaltrials |
DOXAPRAM | clinicaltrials |
DOPRAM | clinicaltrials |
STIMULEXIN | clinicaltrials |
DOPRAM | rxnorm |
DOXAPRAM HYDROCHLORIDE | rxnorm |
953 | DrugCentral |
DTXSID2022963 | EPA CompTox Dashboard |
DOXAPRAM | rxnorm |
3156 | PubChem |
PD009963 | ProbesDrugs |
15078242 | PubChem: Thomson Pharma |
309-29-5 | ACToR |
PA164784026 | PharmGKB |
LSM-5058 | LINCS |
CB4245654 | ChemicalBook |
MolPort-005-933-844 | MolPort |
HMDB0014701 | Human Metabolome Database |
doxapram | DailyMed |
DB00561 | DrugBank |
CHEMBL1754 | ChEMBL |
681848 | ChEBI |
901795 | eMolecules |
The data in this table is sourced from UniChem at EBI. |