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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

4-hydroxy-3-butylphthalide

C12H14O3

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
11

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
4-hydroxy-3-butylphthalide
Molecular Formula
C12H14O3
Molecular Weight
No data
Canonical SMILES
CCCCC1C2=C(C=CC=C2O)C(=O)O1
Isomeric SMILES
CCCCC1C2=C(C=CC=C2O)C(=O)O1
InChI
InChI=1S/C12H14O3/c1-2-3-7-10-11-8(12(14)15-10)5-4-6-9(11)13/h4-6,10,13H,2-3,7H2,1H3
Oral Bioavailability
70.312
Drug Likeness
0.773
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

Active Targets

ingredient target8 Targets
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