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Molecule
Bedaquiline Fumarate
CAS: 845533-86-0 ·
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 845533-86-0
- Molecular Formula
Identifiers
CAS Registry Number
845533-86-0
Names and Synonyms
- Bedaquiline Fumarate Common Name
- 3-Quinolineethanol, 6-bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-, (αS,βR)-, (2E)-2-butenedioate (1:1) (salt) Synonym
- R 403323 Synonym
- Bedaquiline fumarate Synonym
- Sirturo Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Canonical SMILES | O=C(O)C=CC(=O)O.BrC=1C=CC2=NC(OC)=C(C=C2C1)C(C=3C=CC=CC3)C(O)(C4=CC=CC=5C=CC=CC54)CCN(C)C | CAS Common Chemistry |
| InChI | CAS Common Chemistry | |
| InChI Key | CAS Common Chemistry | |
| Name | Bedaquiline fumarate | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
No spectral data available
Spectral data for this molecule is not currently available because there is no SMILES structure.
