Dataset
![molecular Image]()
16485-10-2.
Chemical Info
| InChI | InChI=1S/C9H19NO4/c1-9(2,6-12)7(13)8(14)10-4-3-5-11/h7,11-13H,3-6H2,1-2H3,(H,10,14) |
|---|---|
| SMILES | CC(C)(CO)C(O)C(=O)NCCCO |
| InChI Key | SNPLKNRPJHDVJA-UHFFFAOYSA-N |
| Molecular Formula | C9H19NO4 |
| Exact Mass | 205.250 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.57992/nmrxiv.p10.s60.d276 |
| License URL | https://creativecommons.org/licenses/by/4.0/legalcode |
| Source | https://nmrxiv.org/D276 |
| Version | |
| Author | |
| Maintainer | |
| Language | english |
| MetadataCreated | 2024-05-15T09:11:49.078042 |
| MetadataModified | 2024-09-23T09:37:52.152807 |
| MetadataPublished | 2022-10-28 13:30:58 |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL1371937 | ChEMBL |
| 495606 | eMolecules |
| DB11204 | DrugBank |
| panthenol | DailyMed |
| CB3274109 | ChemicalBook |
| 4678 | PubChem |
| PD000345 | ProbesDrugs |
| LSM-6472 | LINCS |
| 14748785 | PubChem: Thomson Pharma |
| 1113-70-8 | ACToR |
| 16485-10-2 | ACToR |
| 81-13-0 | ACToR |
| MolPort-003-666-718 | MolPort |
| SCHEMBL15567 | SureChEMBL |
| HMDB0304820 | Human Metabolome Database |
| J321.113D | Nikkaji |
| PANTHENOL | DailyMed |
| PANTHENOL | rxnorm |
| DEXPANTHENOL | clinicaltrials |
| WV9CM0O67Z | FDA SRS |
| HY-B1024 | MedChemExpress |
| DTXSID3044598 | EPA CompTox Dashboard |
| ILOPAN | clinicaltrials |
| 40129051 | NMRShiftDB |
| MCULE-2403906933 | Mcule |
| PANTHENOL | clinicaltrials |
| The data in this table is sourced from UniChem at EBI. | |