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白头翁
Bai Tou Weng / Radix Pulsatillae; Pulsatillae Radix
Bai Tou WengRadix Pulsatillae; Pulsatillae Radix
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Zinc01615307
- Molecular Formula
- C22H22O8
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)O)COC3=O
- Isomeric SMILES
- COC1=CC(=CC(=C1OC)OC)[C@@H]2[C@@H]3[C@@H](CC4=C(C5=C(C=C24)OCO5)O)COC3=O
- InChI
- InChI=1S/C22H22O8/c1-25-14-5-10(6-15(26-2)20(14)27-3)17-12-7-16-21(30-9-29-16)19(23)13(12)4-11-8-28-22(24)18(11)17/h5-7,11,17-18,23H,4,8-9H2,1-3H3/t11-,17-,18-/m0/s1
- Oral Bioavailability
- 56.378
- Drug Likeness
- 0.764
- 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.
Source Herbs
herb ingredient1 Herbs