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Ingredients

6-methoxy aurapten

C20H24O4

Entity Type
Ingredients
Relation Groups
2
Relation Preview
11

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
6-methoxy aurapten
Molecular Formula
C20H24O4
Molecular Weight
No data
Canonical SMILES
CC(=CCCC(=CCOC1=C(C=C2C=CC(=O)OC2=C1)OC)C)C
Isomeric SMILES
CC(=CCC/C(=C/COC1=C(C=C2C=CC(=O)OC2=C1)OC)/C)C
InChI
InChI=1S/C20H24O4/c1-14(2)6-5-7-15(3)10-11-23-19-13-17-16(12-18(19)22-4)8-9-20(21)24-17/h6,8-10,12-13H,5,7,11H2,1-4H3/b15-10+
Oral Bioavailability
31.238
Drug Likeness
0.537
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

Direct relations and traceable candidates grouped by relation type.

Source Herbs

herb ingredient3 Herbs
01
枳实
Zhi Shi / Fructus Aurantii Immaturus; Aurantii Fructus Immaturus
Zhi ShiFructus Aurantii Immaturus; Aurantii Fructus Immaturus