01
荜茇
Bi Ba / Fructus Piperis Longi; Piperis Longi Fructus
Bi BaFructus Piperis Longi; Piperis Longi Fructus
Ingredients
(e,e,e)-11-(1,3-benzodioxol-5-yl)-n-(2-methylpropyl)-2,4,10-undecatrienenamide
C22H29NO3
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (e,e,e)-11-(1,3-benzodioxol-5-yl)-n-(2-methylpropyl)-2,4,10-undecatrienenamide
- Molecular Formula
- C22H29NO3
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)CNC(=O)C=CC=CCCCCC=CC1=CC2=C(C=C1)OCO2
- Isomeric SMILES
- CC(C)CNC(=O)/C=C/C=C/CCCC/C=C/C1=CC2=C(C=C1)OCO2
- InChI
- InChI=1S/C22H29NO3/c1-18(2)16-23-22(24)12-10-8-6-4-3-5-7-9-11-19-13-14-20-21(15-19)26-17-25-20/h6,8-15,18H,3-5,7,16-17H2,1-2H3,(H,23,24)/b8-6+,11-9+,12-10+
- Oral Bioavailability
- 42.723
- Drug Likeness
- 0.370
- 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