PC
Summary
| Name: | PHOSPHOCHOLINE |
| Formula: | C5 H15 N O4 P |
| Formal charge: | 1 |
| Formula weight: | 184.151 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,N,N-trimethyl-2-(phosphonooxy)ethanaminium |
| OpenEye OEToolkits | 1.5.0 | trimethyl-(2-phosphonooxyethyl)azanium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC[N+](C)(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[N+](C)(C)CCO[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | C[N+](C)(C)CCO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCOP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCOP(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p+1 |
| InChIKey | InChI | 1.03 | YHHSONZFOIEMCP-UHFFFAOYSA-O |
