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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Embelin

C17H26O4

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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
Embelin
Molecular Formula
C17H26O4
Molecular Weight
No data
Canonical SMILES
CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O
Isomeric SMILES
CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O
InChI
InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h12,18,21H,2-11H2,1H3
Oral Bioavailability
37.718
Drug Likeness
0.465
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
ACHE
acetylcholinesterase (Cartwright blood group)
acetylcholinesterase (Cartwright blood group)
DetailsGraph
04
ALDH1A1
aldehyde dehydrogenase 1 family member A1
aldehyde dehydrogenase 1 family member A1
DetailsGraph
05
ALOX12
arachidonate 12-lipoxygenase, 12S type
arachidonate 12-lipoxygenase, 12S type
DetailsGraph