Dataset

Methandrostenolone

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N100111_A098 contains the MS2 mass spectrum of Methandrostenolone with the InChIkey XWALNWXLMVGSFR-HLXURNFRSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H28O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,12,15-17,22H,4-5,7-8,10-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1
SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CCC4=CC(=O)C=C[C@]34C
InChI Key XWALNWXLMVGSFR-HLXURNFRSA-N
Molecular Formula C20H28O2
Exact Mass 300.209 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-Antwerp_Univ-METOX_N100111_A098
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:40:03.042768
MetadataModified 2025-02-08T18:50:02.449736
MetadataPublished 2022-04-08
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J5.252C Nikkaji
NEQQEH CCDC
1734 DrugCentral
LMST02020013 LipidMaps
DTXSID2023276 EPA CompTox Dashboard
METHANDROSTENOLONE rxnorm
6810 ChEBI
DB13586 DrugBank
CHEMBL1418176 ChEMBL
520782 eMolecules
29537664 eMolecules
PD014157 ProbesDrugs
14873807 PubChem: Thomson Pharma
72-63-9 ACToR
COZ1R7EOCC FDA SRS
MCULE-1812806265 Mcule
6300 PubChem
SCHEMBL140928 SureChEMBL
ZINC000003875469 ZINC
CB7113183 ChemicalBook
CB0502711 ChemicalBook
HMDB0041925 Human Metabolome Database
The data in this table is sourced from UniChem at EBI.