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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

2-butenal

C4H6O

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
2-butenal
Molecular Formula
C4H6O
Molecular Weight
No data
Canonical SMILES
CC=CC=O
Isomeric SMILES
C/C=C/C=O
InChI
InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+
Oral Bioavailability
No data
Drug Likeness
0.329
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
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Direct relations and traceable candidates grouped by relation type.

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