Dataset
Alverine
Chemical Info
InChI | InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3 |
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SMILES | CCN(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2 |
InChI Key | ZPFXAOWNKLFJDN-UHFFFAOYSA-N |
Molecular Formula | C20H27N |
Exact Mass | 281.214 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-Eawag-EQ01163301 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2025-02-09T10:08:43.413559 |
MetadataModified | 2025-02-09T10:08:43.604365 |
MetadataPublished | 2024-01-16 |
Related Molecule |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
CHEMBL253371 | ChEMBL |
DB01616 | DrugBank |
518413 | ChEBI |
SPASMONAL | clinicaltrials |
SPASMAVERINE | clinicaltrials |
ALVERINE | clinicaltrials |
ZINC000001481966 | ZINC |
142 | DrugCentral |
ALVERINE CITRATE | clinicaltrials |
J5.855F | Nikkaji |
ALVERINE | rxnorm |
ALVERINE CITRATE | rxnorm |
CB5333673 | ChemicalBook |
37636 | BindingDB |
DTXSID0048557 | EPA CompTox Dashboard |
PD009447 | ProbesDrugs |
46TIR1560O | FDA SRS |
LSM-3988 | LINCS |
3678 | PubChem |
14972958 | PubChem: Thomson Pharma |
SCHEMBL83067 | SureChEMBL |
150-59-4 | ACToR |
618386 | eMolecules |
MCULE-3553088186 | Mcule |
PA164764505 | PharmGKB |
HMDB0015554 | Human Metabolome Database |
The data in this table is sourced from UniChem at EBI. |