01
麻黄根
Ma Huang Gen / Radix et Rhizoma Ephedrae; Ephedrae Radix et Rhizoma
Ma Huang GenRadix et Rhizoma Ephedrae; Ephedrae Radix et Rhizoma
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Sesquipinsapol b
- Molecular Formula
- C30H36O9
- Molecular Weight
- No data
- Canonical SMILES
- COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CC(CO)C(CC4=CC(=C(C=C4)O)OC)CO
- Isomeric SMILES
- COC1=CC(=CC2=C1O[C@@H]([C@H]2CO)C3=CC(=C(C=C3)O)OC)C[C@@H](CO)[C@@H](CC4=CC(=C(C=C4)O)OC)CO
- InChI
- InChI=1S/C30H36O9/c1-36-26-11-17(4-6-24(26)34)8-20(14-31)21(15-32)9-18-10-22-23(16-33)29(39-30(22)28(12-18)38-3)19-5-7-25(35)27(13-19)37-2/h4-7,10-13,20-21,23,29,31-35H,8-9,14-16H2,1-3H3/t20-,21-,23-,29+/m0/s1
- Oral Bioavailability
- 3.474
- Drug Likeness
- 0.234
- 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