01
两头尖
Liang Tou Jian / Rhizoma Anemones Raddeanae; Anemones Raddeanae Rhizoma
Liang Tou JianRhizoma Anemones Raddeanae; Anemones Raddeanae Rhizoma
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Arctigenin
- Molecular Formula
- C21H24O6
- Molecular Weight
- No data
- Canonical SMILES
- COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)O)OC)OC
- Isomeric SMILES
- COC1=C(C=C(C=C1)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O)OC)OC
- InChI
- InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1
- Oral Bioavailability
- 8.054
- Drug Likeness
- 0.753
- 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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herb ingredient8 Herbs
02
03
天山雪莲
Tian Shan Xue Lian / Herba Saussureae Involucratae; Saussureae Involucratae Herba
Tian Shan Xue LianHerba Saussureae Involucratae; Saussureae Involucratae Herba
04
05
06
07
08