01
Ingredients
Methyl 6-hydroxy-2,2-dimethyl-3,4-dihydrobenzo[h]chromene-5-carboxylate
C17H18O4
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 13
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Methyl 6-hydroxy-2,2-dimethyl-3,4-dihydrobenzo[h]chromene-5-carboxylate
- Molecular Formula
- C17H18O4
- Molecular Weight
- No data
- Canonical SMILES
- CC1(CCC2=C(O1)C3=CC=CC=C3C(=C2C(=O)OC)O)C
- Isomeric SMILES
- CC1(CCC2=C(O1)C3=CC=CC=C3C(=C2C(=O)OC)O)C
- InChI
- InChI=1S/C17H18O4/c1-17(2)9-8-12-13(16(19)20-3)14(18)10-6-4-5-7-11(10)15(12)21-17/h4-7,18H,8-9H2,1-3H3
- Oral Bioavailability
- 51.094
- Drug Likeness
- 0.816
- 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.