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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

3-O-caffeoylquinic acid methyl ester

C17H20O9

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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
3-O-caffeoylquinic acid methyl ester
Molecular Formula
C17H20O9
Molecular Weight
368.300
Canonical SMILES
COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O
Isomeric SMILES
No data
InChI
No data
Oral Bioavailability
No data
Drug Likeness
No data
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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