01
acinar cell
No data
Ingredients
[(3s,3ar,6s,7ar)-6-hydroxy-6-methyl-2,5-dioxo-3a,4,7,7a-tetrahydro-3h-benzofuran-3-yl]methyl benzoate
C17H18O6
- Entity Type
- Ingredients
- Relation Groups
- 4
- Relation Preview
- 25
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- [(3s,3ar,6s,7ar)-6-hydroxy-6-methyl-2,5-dioxo-3a,4,7,7a-tetrahydro-3h-benzofuran-3-yl]methyl benzoate
- Molecular Formula
- C17H18O6
- Molecular Weight
- No data
- Canonical SMILES
- CC1(CC2C(CC1=O)C(C(=O)O2)COC(=O)C3=CC=CC=C3)O
- Isomeric SMILES
- CC1(CC2C(CC1=O)C(C(=O)O2)COC(=O)C3=CC=CC=C3)O
- InChI
- InChI=1S/C17H18O6/c1-17(21)8-13-11(7-14(17)18)12(16(20)23-13)9-22-15(19)10-5-3-2-4-6-10/h2-6,11-13,21H,7-9H2,1H3
- Oral Bioavailability
- 17.843
- Drug Likeness
- 0.840
- 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.
Related Cells
ingredient cell8 Cells
02
adipocyte progenitor cells
No data
03
adipocytes
No data
04
alpha cell
No data
05
alpha cell (α cell)
No data
06
alpha cells
No data
07
alveolar macrophage
No data
08