01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Castanin
- Molecular Formula
- C17H14O5
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC=C(C=C1)C2=COC3=CC(=C(C=C3C2=O)OC)O
- Isomeric SMILES
- COC1=CC=C(C=C1)C2=COC3=CC(=C(C=C3C2=O)OC)O
- InChI
- InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-15-8-14(18)16(21-2)7-12(15)17(13)19/h3-9,18H,1-2H3
- Oral Bioavailability
- 23.541
- Drug Likeness
- 0.804
- 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.
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甘草
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Gan CaoRadix et Rhizoma Glycyrrhizae; Glycyrrhizae Radix et Rhizoma
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