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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

(-)-Methyl 2-methylbutyrate

644216

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Entity Type
Ingredients
Relation Groups
5
Relation Preview
29

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(-)-Methyl 2-methylbutyrate
Molecular Formula
No data
Molecular Weight
116.180
Canonical SMILES
CCC(C)C(=O)OC
Isomeric SMILES
No data
InChI
No data
Oral Bioavailability
71.348
Drug Likeness
No data
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
644216

Description and Extensions

Toxicity Information
No data
Related

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive TargetsRelated SyndromesRelated TCM SymptomsRelated Modern Symptoms

Active Targets

ingredient target6 Targets
GraphMore Targets
01
AKR1B1
aldo-keto reductase family 1 member B
aldo-keto reductase family 1 member B
DetailsGraph
05
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
DetailsGraph