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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

Isopimpinellin

C13H10O5

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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
Isopimpinellin
Molecular Formula
C13H10O5
Molecular Weight
No data
Canonical SMILES
COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC
Isomeric SMILES
COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC
InChI
InChI=1S/C13H10O5/c1-15-10-7-3-4-9(14)18-12(7)13(16-2)11-8(10)5-6-17-11/h3-6H,1-2H3
Oral Bioavailability
25.929
Drug Likeness
0.650
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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Direct relations and traceable candidates grouped by relation type.

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