Dataset

Carbazochrome sulfonate

This MassBank record with Accession MSBNK-RIKEN-PR300498 contains the MS2 mass spectrum of Carbazochrome sulfonate with the InChIkey OZCACMPSTYQSMM-SDQBBNPISA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H12N4O5S/c1-14-7-4-8(15)6(12-13-10(11)16)2-5(7)3-9(14)20(17,18)19/h2,4,9H,3H2,1H3,(H3,11,13,16)(H,17,18,19)/b12-6-
SMILES CN1C(CC2=C\C(=N\NC(O)=N)C(=O)C=C12)S(O)(=O)=O
InChI Key OZCACMPSTYQSMM-SDQBBNPISA-N
Molecular Formula C10H12N4O5S
Exact Mass 300.294 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-PR300498
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:43:22.924327
MetadataModified 2024-01-11T20:43:23.093942
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PD063137 ProbesDrugs
CARBAZOCHROME SODIUM SULFONATE clinicaltrials
AC 17 clinicaltrials
AC-17 clinicaltrials
ADONA clinicaltrials
70063-04-6 ACToR
SCHEMBL9816914 SureChEMBL
BMQ12812QR FDA SRS
DB15969 DrugBank
CARBAZOCHROME SODIUM SULFONATE rxnorm
CHEMBL1697827 ChEMBL
The data in this table is sourced from UniChem at EBI.