01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1-acetoxy-2,4-dihydroxy-n-heptadeca-16-yne
- Molecular Formula
- C19H34O4
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)OCC(CC(CCCCCCCCCCCC#C)O)O
- Isomeric SMILES
- CC(=O)OCC(CC(CCCCCCCCCCCC#C)O)O
- InChI
- InChI=1S/C19H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,18-19,21-22H,4-16H2,2H3
- Oral Bioavailability
- No data
- Drug Likeness
- 0.274
- 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