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Ingredients
{5-[2'(r)-hydroxy-3'-methyl-3'-butenyl-oxy]furocoumarin}
C16H14O5
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- {5-[2'(r)-hydroxy-3'-methyl-3'-butenyl-oxy]furocoumarin}
- Molecular Formula
- C16H14O5
- Molecular Weight
- No data
- Canonical SMILES
- CC(=C)C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
- Isomeric SMILES
- CC(=C)[C@@H](COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
- InChI
- InChI=1S/C16H14O5/c1-9(2)12(17)8-20-16-10-3-4-15(18)21-14(10)7-13-11(16)5-6-19-13/h3-7,12,17H,1,8H2,2H3/t12-/m1/s1
- Oral Bioavailability
- 42.851
- Drug Likeness
- 0.589
- 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.
Active Targets
ingredient target8 Targets
02
03
04
05
06
07
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
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