ChemGrid

CHEMGRID MOLECULE CARD

GITOXIN

GITOXIN in ChemGrid: 114 screened assays, 0 with significant responses. Explore chemical identifiers, strain activity and target evidence.

SPE01500986

Explore activity & SONAR
Chemical structure of GITOXIN
Stored molecular structure
114Screened assays
0Significant assay responses
1Source-labelled target records

Identity and chemistry

ChemGrid identifier
SPE01500986
Molecular formula
C41H64O14
CAS registry number
4562-36-1
InChIKey
LKRDZKPBAOKJBT-UHFFFAOYSA-N
Libraries
Spectrum, Spectrum_ED
Other recorded names
Gitoxoside
Stored SMILESCC1OC(CC(O)C1O)OC1C(O)CC(OC1C)OC1C(O)CC(OC1C)OC1CCC2(C)C(CCC3C2CCC2(C)C(C(O)CC32O)C2COC(=O)C=2)C1

Matched external records: PubChem 261947

Chemical identifiers and library names are reproduced from ChemGrid records. Missing values are omitted.

Measured chemical–genetic activity

114 measurements across 114 distinct library–species–strain assays; 0 assays have at least one significant response (|Z| ≥ 4, p ≤ 0.001, excluding flagged outliers).

Responses are indirect screening phenotypes. They do not establish that a strain gene is a direct molecular target. Strains and timepoints are retained as recorded; these counts are not counts of unique ORFs.

Recorded target evidence and yeast matches

Source annotations are shown separately from SONAR hypotheses. Evidence type and identity matching can vary; consult the linked source and interactive evidence panel.

TargetSourceYeast ORF / orthologue
rep · Replicase polyprotein 1abChEMBL analogueNo stored yeast mapping

Structural activity predictions and SONAR

Stored structural activity predictions are available in the interactive profile, with assay-specific cutoffs and applicability-domain assessments.

SONAR ranks candidate targets through genetic and physical interaction evidence. Structural SONAR uses predicted strain responses; measured SONAR uses experimental responses. These are experimental hypotheses, not confirmed binding targets. Outside-domain predictions are treated as unknown.

Open the complete GITOXIN research profile →

Sources and provenance

Screening measurements: ChemGrid chemical-genetic datasets. Wildenhain et al., Cell Systems (2015). Target annotations: sources named in the evidence table. Structure and library metadata: stored ChemGrid catalogue records.

Card snapshot: 2026-11-02. Linked interactive views may contain newer data.