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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Protocatechualdehyde

C7H6O3

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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
Protocatechualdehyde
Molecular Formula
C7H6O3
Molecular Weight
No data
Canonical SMILES
C1=CC(=C(C=C1C=O)O)O
Isomeric SMILES
C1=CC(=C(C=C1C=O)O)O
InChI
InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H
Oral Bioavailability
38.350
Drug Likeness
0.448
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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