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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Ethyl caffeate

C11H12O4

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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
Ethyl caffeate
Molecular Formula
C11H12O4
Molecular Weight
No data
Canonical SMILES
CCOC(=O)C=CC1=CC(=C(C=C1)O)O
Isomeric SMILES
CCOC(=O)/C=C/C1=CC(=C(C=C1)O)O
InChI
InChI=1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+
Oral Bioavailability
103.851
Drug Likeness
0.450
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.

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