Dataset

Fumiquinazoline H

This MassBank record with Accession MSBNK-AAFC-AC000664 contains the MS2 mass spectrum of Fumiquinazoline H with the InChIkey SJNRYASCJOVKHZ-MBLBISRUSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C27H27N5O4/c1-14(2)12-18-23(35)31-19-11-7-5-9-16(19)27(25(31)29-18)13-20-21(33)30-26(3,36-27)24-28-17-10-6-4-8-15(17)22(34)32(20)24/h4-11,14,18,20,25,29H,12-13H2,1-3H3,(H,30,33)/t18-,20+,25?,26+,27+/m0/s1
SMILES CC(C)C[C@H]1C(=O)N2C(N1)[C@@]3(C[C@@H]4C(=O)N[C@](O3)(C5=NC6=CC=CC=C6C(=O)N45)C)C7=CC=CC=C72
InChI Key SJNRYASCJOVKHZ-MBLBISRUSA-N
Molecular Formula C27H27N5O4
Exact Mass 485.206 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000664
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:24:53.706575
MetadataModified 2024-01-11T09:24:53.840386
MetadataPublished 2017-07-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
101027374 PubChem
J1.296.983J Nikkaji
184049 ChEBI
The data in this table is sourced from UniChem at EBI.