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Ingredients

Fraxinellone

C14H16O3

Entity Type
Ingredients
Relation Groups
2
Relation Preview
16

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
Fraxinellone
Molecular Formula
C14H16O3
Molecular Weight
No data
Canonical SMILES
CC1=C2C(=O)OC(C2(CCC1)C)C3=COC=C3
Isomeric SMILES
CC1=C2C(=O)O[C@H]([C@@]2(CCC1)C)C3=COC=C3
InChI
InChI=1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m0/s1
Oral Bioavailability
35.955
Drug Likeness
0.697
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

Direct relations and traceable candidates grouped by relation type.

Source Herbs

herb ingredient8 Herbs
06
白鲜皮
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