01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Tetrahydrobungeanool
- Molecular Formula
- C18H33NO2
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCCCCCC=CC=CC(=O)NCC(C)(C)O
- Isomeric SMILES
- CCCCCCCCC/C=C/C=C/C(=O)NCC(C)(C)O
- InChI
- InChI=1S/C18H33NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(2,3)21/h12-15,21H,4-11,16H2,1-3H3,(H,19,20)/b13-12+,15-14+
- Oral Bioavailability
- No data
- Drug Likeness
- 0.323
- 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