01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Acutuminine
- Molecular Formula
- C19H24ClNO5
- Molecular Weight
- No data
- Canonical SMILES
- CN1CCC23C1(CC(C24CC(=CC4=O)OC)Cl)C(=C(C(=O)C3)OC)OC
- Isomeric SMILES
- CN1CC[C@@]23[C@@]1(C[C@@H]([C@@]24CC(=CC4=O)OC)Cl)C(=C(C(=O)C3)OC)OC
- InChI
- InChI=1S/C19H24ClNO5/c1-21-6-5-17-9-12(22)15(25-3)16(26-4)19(17,21)10-13(20)18(17)8-11(24-2)7-14(18)23/h7,13H,5-6,8-10H2,1-4H3/t13-,17-,18+,19+/m0/s1
- Oral Bioavailability
- 39.288
- 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
Related Entities
Direct relations and traceable candidates grouped by relation type.