01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 16
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Piperitylhonokiol
- Molecular Formula
- C28H34O2
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC(C(CC1)C(C)C)C2=CC(=CC(=C2O)C3=CC(=C(C=C3)O)CC=C)CC=C
- Isomeric SMILES
- CC1=C[C@H]([C@@H](CC1)C(C)C)C2=CC(=CC(=C2O)C3=CC(=C(C=C3)O)CC=C)CC=C
- InChI
- InChI=1S/C28H34O2/c1-6-8-20-15-24(21-11-13-27(29)22(17-21)9-7-2)28(30)26(16-20)25-14-19(5)10-12-23(25)18(3)4/h6-7,11,13-18,23,25,29-30H,1-2,8-10,12H2,3-5H3/t23-,25+/m0/s1
- Oral Bioavailability
- 4.483
- Drug Likeness
- 0.476
- 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 ingredient8 Herbs
02
03
厚朴
Hou Po / Cortex Magnoliae Officinalis; Magnoliae Officinalis Cortex
Hou PoCortex Magnoliae Officinalis; Magnoliae Officinalis Cortex
04
05
胡黄连
Hu Huang Lian / Rhizoma Picrorhizae; Picrorhizae Rhizoma
Hu Huang LianRhizoma Picrorhizae; Picrorhizae Rhizoma
06
07
荆芥
Jing Jie / Herba Schizonepetae; Schizonepetae Herba
Jing JieHerba Schizonepetae; Schizonepetae Herba
08
