Dataset

Rhamnopterin

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82068 contains the MS mass spectrum of Rhamnopterin with the InChIkey QSVZLFABRHDXRR-ZIMNBKJVSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H13N5O4/c1-3(16)6(17)7(18)4-2-12-8-5(13-4)9(19)15-10(11)14-8/h2-3,6-7,16-18H,1H3,(H3,11,12,14,15,19)/t3-,6-,7-/m0/s1
SMILES C[C@@H]([C@@H]([C@H](C1=CN=C2C(=N1)C(=O)N=C(N2)N)O)O)O
InChI Key QSVZLFABRHDXRR-ZIMNBKJVSA-N
Molecular Formula C10H13N5O4
Exact Mass 267.097 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-Washington_State_Univ-BML82068
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:24:49.284295
MetadataModified 2024-01-11T22:24:49.459611
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
135484652 PubChem
ZINC000007998083 ZINC
531315 eMolecules
CHEMBL1447406 ChEMBL
The data in this table is sourced from UniChem at EBI.