Skip to main content
Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

2,3,4-trimethylhexane

C9H20

View Knowledge GraphBack to List
Entity Type
Ingredients
Relation Groups
2
Relation Preview
7

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
2,3,4-trimethylhexane
Molecular Formula
C9H20
Molecular Weight
No data
Canonical SMILES
CCC(C)C(C)C(C)C
Isomeric SMILES
CCC(C)C(C)C(C)C
InChI
InChI=1S/C9H20/c1-6-8(4)9(5)7(2)3/h7-9H,6H2,1-5H3
Oral Bioavailability
38.905
Drug Likeness
0.547
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive Targets

Source Herbs

herb ingredient4 Herbs
GraphMore Herbs
01
大蓟
Da Ji / Herba Cirsii Japonici; Cirsii Japonici Herba
Da JiHerba Cirsii Japonici; Cirsii Japonici Herba
DetailsGraph
02
山楂
Shan Zha / Fructus Crataegi; Crataegi Fructus
Shan ZhaFructus Crataegi; Crataegi Fructus
DetailsGraph
03
蛇床子
She Chuang Zi / Cnidii Fructus; Fructus Cnidii
She Chuang ZiCnidii Fructus; Fructus Cnidii
DetailsGraph