Dataset
Nortryptyline
Chemical Info
InChI | InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3 |
---|---|
SMILES | CNCCC=C(c21)c(c3)c(ccc3)CCc(cccc2)1 |
InChI Key | PHVGLTMQBUFIQQ-UHFFFAOYSA-N |
Molecular Formula | C19H21N |
Exact Mass | 263.167 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-WA000741 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T22:47:39.025435 |
MetadataModified | 2024-01-11T22:47:39.195458 |
MetadataPublished | 2016-01-19 |
Field | Value |
---|---|
Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
DTXSID9023384 | EPA CompTox Dashboard |
ZINC000001530741 | ZINC |
112777 | BindingDB |
NORTRIPTYLINE | DailyMed |
NORTRIPTYLINE | rxnorm |
NORTRIPTYLINE HYDROCHLORIDE | rxnorm |
PAMELOR | rxnorm |
PAMELOR | clinicaltrials |
AVENTYL | clinicaltrials |
NORTRILEN | clinicaltrials |
NORTRIPTYLINE | clinicaltrials |
NORTRIPTYLINE HYDROCHLORIDE | clinicaltrials |
1971 | DrugCentral |
75635 | Brenda |
11504 | Brenda |
145062 | Brenda |
nortriptyline | DailyMed |
CB1317147 | ChemicalBook |
MTBLC7640 | Metabolights |
HMDB0014680 | Human Metabolome Database |
145976 | Brenda |
4543 | PubChem |
14799043 | PubChem: Thomson Pharma |
60027264 | NMRShiftDB |
PD009970 | ProbesDrugs |
PA450657 | PharmGKB |
LSM-4039 | LINCS |
SCHEMBL34527 | SureChEMBL |
72-69-5 | ACToR |
BL03SY4LXB | FDA SRS |
21B | PDBe |
J5.253A | Nikkaji |
C07274 | KEGG Ligand |
DB00540 | DrugBank |
CHEMBL445 | ChEMBL |
7640 | ChEBI |
2404 | Guide to Pharmacology |
The data in this table is sourced from UniChem at EBI. |