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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Bergaptol

C11H6O4

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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
Bergaptol
Molecular Formula
C11H6O4
Molecular Weight
No data
Canonical SMILES
C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O
Isomeric SMILES
C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O
InChI
InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H
Oral Bioavailability
24.221
Drug Likeness
0.568
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
GraphMore Targets
01
ABCB1
ATP binding cassette subfamily B member 1
ATP binding cassette subfamily B member 1
DetailsGraph
02
ALDH1A1
aldehyde dehydrogenase 1 family member A1
aldehyde dehydrogenase 1 family member A1
DetailsGraph
06
CYP2A6
cytochrome P450 family 2 subfamily A member 6
cytochrome P450 family 2 subfamily A member 6
DetailsGraph
07
CYP3A4
cytochrome P450 family 3 subfamily A member 4
cytochrome P450 family 3 subfamily A member 4
DetailsGraph