01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Methylenetanshinquinone
- Molecular Formula
- C18H14O3
- Molecular Weight
- No data
- Canonical SMILES
- CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4=C
- Isomeric SMILES
- CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4=C
- InChI
- InChI=1S/C18H14O3/c1-9-4-3-5-12-11(9)6-7-13-15(12)17(20)16(19)14-10(2)8-21-18(13)14/h6-8H,1,3-5H2,2H3
- Oral Bioavailability
- 37.073
- Drug Likeness
- 0.685
- 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
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