Dataset

Strychnine; LC-ESI-Q; MS; POS; 15 V, 45 V

This MassBank record with Accession MSBNK-Waters-WA000648 contains the MS mass spectrum of Strychnine with the InChIkey QMGVPVSNSZLJIA-FVWCLLPLSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
SMILES c(c7)cc(c(c7)1)N(C(=O)6)C([H])(C([H])45)C(C2)1C(C3)N(CC(=CCOC([H])(C6)5)C34)C2
InChI Key QMGVPVSNSZLJIA-FVWCLLPLSA-N
Molecular Formula C21H22N2O2
Exact Mass 334.168 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA000648
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • (4aR,5aS,8aR,13aS,15aS,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB15954 drugbank
    CHEBI:28973 chebi
    SY9 rcsb_pdb
    CHEMBL227934 chembl
    14029424 surechembl
    93798 surechembl
    441071 pubchem
    H9Y79VD43J fdasrs
    PD014394 probes_and_drugs
    ZZZUEE CCDC
    252948 brenda
    50609266 bindingdb
    50690152 bindingdb
    50690154 bindingdb
    50690162 bindingdb
    50690163 bindingdb
    50690164 bindingdb
    50690275 bindingdb
    50690282 bindingdb
    51248423 bindingdb
    51248426 bindingdb
    51248429 bindingdb
    51248430 bindingdb
    51248432 bindingdb
    51248434 bindingdb
    51248437 bindingdb
    51411679 bindingdb
    51411680 bindingdb
    51411733 bindingdb
    51411734 bindingdb
    51411787 bindingdb
    51411800 bindingdb
    51411804 bindingdb
    51411809 bindingdb
    51411814 bindingdb
    2484 drugcentral
    The data in this table is sourced from UniChem at EBI.