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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

(6r)-6-butylcyclohepta-1,4-diene

C11H18

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
6

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(6r)-6-butylcyclohepta-1,4-diene
Molecular Formula
C11H18
Molecular Weight
No data
Canonical SMILES
CCCCC1CC=CCC=C1
Isomeric SMILES
CCCC[C@@H]1CC=CCC=C1
InChI
InChI=1S/C11H18/c1-2-3-8-11-9-6-4-5-7-10-11/h4,6-7,10-11H,2-3,5,8-9H2,1H3/t11-/m1/s1
Oral Bioavailability
31.693
Drug Likeness
0.538
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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当归
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