Dataset

10-hydroxy-Camptothecin; LC-APCI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82447 contains the MS mass spectrum of 10-hydroxy-Camptothecin with the InChIkey HAWSQZCWOQZXHI-FQEVSTJZSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1
SMILES CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)O)O
InChI Key HAWSQZCWOQZXHI-FQEVSTJZSA-N
Molecular Formula C20H16N2O5
Exact Mass 364.106 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-BML82447
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • (19S)-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    16124509 PubChem: Thomson Pharma
    19685-09-7 ACToR
    SCHEMBL25875 SureChEMBL
    70005121 NMRShiftDB
    PD001274 ProbesDrugs
    LSM-4685 LINCS
    10-hydroxycamptothecin Selleck
    2725974 eMolecules
    29542718 eMolecules
    97226 PubChem
    9Z01632KRV FDA SRS
    DB12385 DrugBank
    29298 Brenda
    CB4445430 ChemicalBook
    ZINC000003979155 ZINC
    CB12129661 ChemicalBook
    227935 Brenda
    50008922 BindingDB
    10-HYDROXYCAMPTOTHECIN clinicaltrials
    HYDROXYCAMPTOTHECIN clinicaltrials
    YAWYAA CCDC
    81395 ChEBI
    J3.021.724A Nikkaji
    J258.662B Nikkaji
    HY-N0095 MedChemExpress
    CHEMBL273862 ChEMBL
    C17939 KEGG Ligand
    12015125 PubChem: Drugs of the Future
    The data in this table is sourced from UniChem at EBI.