Herb Integrative Database

Traditional Medicine Data Platform

Ingredients

(6r)-2-methyl-6-(4-methylphenyl)hept-2-en-4-one

C15H20O

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Entity Type: Ingredients
Relation Groups: 2
Relation Preview: 12

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name: (6r)-2-methyl-6-(4-methylphenyl)hept-2-en-4-one
Molecular Formula: C15H20O
Molecular Weight: No data
Canonical SMILES: CC1=CC=C(C=C1)C(C)CC(=O)C=C(C)C
Isomeric SMILES: CC1=CC=C(C=C1)[C@H](C)CC(=O)C=C(C)C
InChI: InChI=1S/C15H20O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-9,13H,10H2,1-4H3/t13-/m1/s1
Oral Bioavailability: 40.842
Drug Likeness: 0.695
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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