ModelSEED Biochemistry
kbase_msd_biochemistry
Philosophy
Enable metabolic modeling and pathway analysis. Map genes to reactions, understand metabolic capabilities, and support flux balance analysis.
Citation & Attribution
Provider: ModelSEED / Henry Lab
Website: https://modelseed.org/
Scale
Schema Browser
molecule
45,708 rows
| Column | Type | Description |
|---|---|---|
id |
string | **Primary Key**. ModelSEED compound ID (e.g., `seed.compound:cpd00001`) |
name |
string | Compound name |
abbreviation |
string | Short name |
formula |
string | Molecular formula |
charge |
int | Net charge |
mass |
float | Molecular mass |
deltag |
float | Gibbs free energy of formation |
deltagerr |
float | Uncertainty in deltaG |
smiles |
string | SMILES structure |
inchikey |
string | InChIKey identifier |
pka |
string | Acid dissociation constants |
pkb |
string | Base dissociation constants |
source |
string | Data source |
Sample Queries
Get reactions
SELECT *
FROM kbase_msd_biochemistry.reaction
LIMIT 20
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