Dataset
![molecular Image]()
Acyclovir
Chemical Info
| InChI | InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15) |
|---|---|
| SMILES | OCCOCn(c2)c(N1)c(n2)C(=O)N=C(N)1 |
| InChI Key | MKUXAQIIEYXACX-UHFFFAOYSA-N |
| Molecular Formula | C8H11N5O3 |
| Exact Mass | 225.086 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-WA001204 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:47:53.790377 |
| MetadataModified | 2024-01-11T22:47:53.967529 |
| MetadataPublished | 2016-01-19 |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| SAM002589967 | NIH Clinical Collection |
| 15172245 | PubChem: Thomson Pharma |
| ZINC000001530555 | ZINC |
| 173055 | Brenda |
| 17698 | Brenda |
| 154360 | Brenda |
| 4406 | Brenda |
| 166474 | Brenda |
| 153377 | Brenda |
| HMDB0014925 | Human Metabolome Database |
| 135398513 | PubChem |
| acyclovir | DailyMed |
| CB7126677 | ChemicalBook |
| DTXSID1022556 | EPA CompTox Dashboard |
| 3062 | Brenda |
| 85 | DrugCentral |
| 50021776 | BindingDB |
| ACYCLOVIR | DailyMed |
| ACYCLOVIR | rxnorm |
| LYPSYL | rxnorm |
| SITAVIG | rxnorm |
| ACYCLOVIR SODIUM | rxnorm |
| ZOVIRAX | rxnorm |
| SITAVIG | clinicaltrials |
| ACYCLOVIR | clinicaltrials |
| ACICLOVIR | clinicaltrials |
| ACICLOVIR SODIUM | clinicaltrials |
| BW 248U | clinicaltrials |
| ACYCLOVIR SODIUM | clinicaltrials |
| HY-17422 | MedChemExpress |
| ZOVIRAX | clinicaltrials |
| 50103518 | BindingDB |
| 15220533 | PubChem: Thomson Pharma |
| PD000980 | ProbesDrugs |
| X4HES1O11F | FDA SRS |
| LSM-5459 | LINCS |
| 14773677 | PubChem: Thomson Pharma |
| 59277-89-3 | ACToR |
| SCHEMBL3175 | SureChEMBL |
| PA448045 | PharmGKB |
| Acyclovir(Aciclovir) | Selleck |
| MCULE-2703274259 | Mcule |
| 20025956 | NMRShiftDB |
| MECWIC | CCDC |
| 4829 | Guide to Pharmacology |
| J11.247J | Nikkaji |
| 12013356 | PubChem: Drugs of the Future |
| C06810 | KEGG Ligand |
| AC2 | PDBe |
| DB00787 | DrugBank |
| 2453 | ChEBI |
| CHEMBL184 | ChEMBL |
| 901331 | eMolecules |
| 29702921 | eMolecules |
| 768732 | eMolecules |
| The data in this table is sourced from UniChem at EBI. | |