Dataset

Camptothecin; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80870 contains the MS mass spectrum of Camptothecin with the InChIkey VSJKWCGYPAHWDS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3
SMILES CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O
InChI Key VSJKWCGYPAHWDS-UHFFFAOYSA-N
Molecular Formula C20H16N2O4
Exact Mass 348.111 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-BML80870
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:91620 chebi
    CHEMBL276820 chembl
    2298909 surechembl
    2538 pubchem
    PD046092 probes_and_drugs
    HMDB0245602 hmdb
    Molport-001-738-744 molport
    50045363 bindingdb
    The data in this table is sourced from UniChem at EBI.