Dataset
![molecular Image]()
Propoxyphene
Chemical Info
| InChI | InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3/t18-,22+/m1/s1 |
|---|---|
| SMILES | CCC(=O)OC(Cc(c2)cccc2)(c(c1)cccc1)C([H])(C)CN(C)C |
| InChI Key | XLMALTXPSGQGBX-GCJKJVERSA-N |
| Molecular Formula | C22H29NO2 |
| Exact Mass | 339.220 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-WA000277 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:32:39.985646 |
| MetadataModified | 2025-02-09T20:27:28.700493 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| PROPOXYPHENE | clinicaltrials |
| DARVON-N | clinicaltrials |
| PROPOXYPHENE NAPSYLATE | clinicaltrials |
| DOLENE | clinicaltrials |
| II2G62OV6F | FDA SRS |
| PROPOXYPHENE HYDROCHLORIDE | clinicaltrials |
| DARVON | clinicaltrials |
| DEXTROPROPOXYPHENE HYDROCHLORIDE | clinicaltrials |
| DEXTROPROPOXYPHENE | clinicaltrials |
| PROPOXYPHENE NAPSYLATE | rxnorm |
| PROPOXYPHENE | rxnorm |
| PROPOXYPHENE HYDROCHLORIDE | rxnorm |
| PROPOXYPHENE | DailyMed |
| 82269 | BindingDB |
| DB00647 | DrugBank |
| DEXPRO | CCDC |
| J5.928E | Nikkaji |
| 7593 | Guide to Pharmacology |
| ZINC000001530769 | ZINC |
| 844 | DrugCentral |
| DTXSID1023524 | EPA CompTox Dashboard |
| CHEMBL1213351 | ChEMBL |
| 51173 | ChEBI |
| 10100 | PubChem |
| SCHEMBL25405 | SureChEMBL |
| 145068 | Brenda |
| propoxyphene | DailyMed |
| 145982 | Brenda |
| 15025964 | PubChem: Thomson Pharma |
| PD009225 | ProbesDrugs |
| S2F83W92TK | FDA SRS |
| 469-62-5 | ACToR |
| 21086-94-2 | ACToR |
| The data in this table is sourced from UniChem at EBI. | |