01
Ingredients
3-(2-keto-3-methyl-but-3-enyl)-4,8-dimethoxy-carbostyril
C16H17NO4
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 10
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3-(2-keto-3-methyl-but-3-enyl)-4,8-dimethoxy-carbostyril
- Molecular Formula
- C16H17NO4
- Molecular Weight
- No data
- Canonical SMILES
- CC(=C)C(=O)CC1=C(C2=C(C(=CC=C2)OC)NC1=O)OC
- Isomeric SMILES
- CC(=C)C(=O)CC1=C(C2=C(C(=CC=C2)OC)NC1=O)OC
- InChI
- InChI=1S/C16H17NO4/c1-9(2)12(18)8-11-15(21-4)10-6-5-7-13(20-3)14(10)17-16(11)19/h5-7H,1,8H2,2-4H3,(H,17,19)
- Oral Bioavailability
- 86.457
- Drug Likeness
- 0.856
- 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.
Source Herbs
herb ingredient2 Herbs