3IK
Summary
| Name: | (2~{R})-1-[(2~{R})-1-[(2~{S})-1-[(2~{S})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine |
| Formula: | C15 H33 N O5 |
| Formal charge: | 0 |
| Formula weight: | 307.426 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-1-[(2~{R})-1-[(2~{S})-1-[(2~{S})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H33NO5/c1-12(16)8-19-14(3)10-21-15(4)11-20-13(2)9-18-7-6-17-5/h12-15H,6-11,16H2,1-5H3/t12-,13+,14-,15+/m1/s1 |
| InChIKey | InChI | 1.03 | JXGRSFWTZMOYKY-BARDWOONSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCOC[C@H](C)OC[C@H](C)OC[C@@H](C)OC[C@@H](C)N |
| SMILES | CACTVS | 3.385 | COCCOC[CH](C)OC[CH](C)OC[CH](C)OC[CH](C)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](CO[C@H](C)CO[C@@H](C)CO[C@@H](C)COCCOC)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(COC(C)COC(C)COC(C)COCCOC)N |
