Dataset

Finasteride

This MassBank record with Accession MSBNK-UFZ-UF411503 contains the MS2 mass spectrum of Finasteride with the InChIkey DBEPLOCGEIEOCV-WSBQPABSSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1
SMILES CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
InChI Key DBEPLOCGEIEOCV-WSBQPABSSA-N
Molecular Formula C23H36N2O2
Exact Mass 372.278 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF411503
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:42:25.723479
MetadataModified 2025-02-09T19:45:57.977509
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PROPECIA clinicaltrials
MK-906 clinicaltrials
HY-13635 MedChemExpress
J367.472J Nikkaji
DTXSID3020625 EPA CompTox Dashboard
PROPECIA rxnorm
1171 DrugCentral
50334788 BindingDB
6818 Guide to Pharmacology
PROSCAR rxnorm
WOLXOK CCDC
FINASTERIDE DailyMed
FINASTERIDE rxnorm
FINASTERIDE clinicaltrials
PROSCAR clinicaltrials
CHEMBL710 ChEMBL
FIT PDBe
SAM001246541 NIH Clinical Collection
DB01216 DrugBank
5062 ChEBI
12014292 PubChem: Drugs of the Future
PA449627 PharmGKB
1012 Brenda
132256 Brenda
40816 Brenda
HMDB0001984 Human Metabolome Database
CB9433852 ChemicalBook
finasteride DailyMed
ZINC000003782599 ZINC
57363 PubChem
PD002995 ProbesDrugs
57GNO57U7G FDA SRS
LSM-1999 LINCS
SCHEMBL5509 SureChEMBL
14926633 PubChem: Thomson Pharma
Finasteride Selleck
14779683 PubChem: Thomson Pharma
98319-26-7 ACToR
538270 eMolecules
27520086 eMolecules
The data in this table is sourced from UniChem at EBI.