01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 7
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 8-deoxylactucin
- Molecular Formula
- C15H16O4
- Molecular Weight
- No data
- Canonical SMILES
- CC1=C2C(C3C(CC1)C(=C)C(=O)O3)C(=CC2=O)CO
- Isomeric SMILES
- CC1=C2[C@@H]([C@@H]3[C@@H](CC1)C(=C)C(=O)O3)C(=CC2=O)CO
- InChI
- InChI=1S/C15H16O4/c1-7-3-4-10-8(2)15(18)19-14(10)13-9(6-16)5-11(17)12(7)13/h5,10,13-14,16H,2-4,6H2,1H3/t10-,13-,14-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.570
- 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
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Direct relations and traceable candidates grouped by relation type.
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