Dataset

Hirsuteine

This MassBank record with Accession MSBNK-RIKEN-PR304589 contains the MS2 mass spectrum of Hirsuteine with the InChIkey TZUGIFAYWNNSAO-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H26N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h4-8,13-14,17,20,23H,1,9-12H2,2-3H3
SMILES COC=C(C1CC2N(CCC3=C2NC2=CC=CC=C32)CC1C=C)C(=O)OC
InChI Key TZUGIFAYWNNSAO-UHFFFAOYSA-N
Molecular Formula C22H26N2O3
Exact Mass 366.461 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304589
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:45:04.418777
MetadataModified 2025-02-09T18:23:39.746312
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
3281521 PubChem
HMDB0250477 Human Metabolome Database
PD130360 ProbesDrugs
181646 ChEBI
The data in this table is sourced from UniChem at EBI.