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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

(e)-6-methyl-3,5-heptadien-2-one

C8H12O

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Entity Type
Ingredients
Relation Groups
2
Relation Preview
3

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
(e)-6-methyl-3,5-heptadien-2-one
Molecular Formula
C8H12O
Molecular Weight
No data
Canonical SMILES
CC(=CC=CC(=O)C)C
Isomeric SMILES
CC(=C/C=C/C(=O)C)C
InChI
InChI=1S/C8H12O/c1-7(2)5-4-6-8(3)9/h4-6H,1-3H3/b6-4+
Oral Bioavailability
59.324
Drug Likeness
0.407
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.

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