E3C
Summary
| Name: | 3-ethyl, cytidine-5'-monophosphate |
| Formula: | C11 H20 N3 O8 P |
| Formal charge: | 0 |
| Formula weight: | 353.266 Da |
| Component type: | RNA linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [(2~{R},3~{S},4~{R},5~{R})-5-(4-azanyl-3-ethyl-2-oxidanylidene-4~{H}-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H20N3O8P/c1-2-13-7(12)3-4-14(11(13)17)10-9(16)8(15)6(22-10)5-21-23(18,19)20/h3-4,6-10,15-16H,2,5,12H2,1H3,(H2,18,19,20)/t6-,7?,8-,9-,10-/m1/s1 |
| InChIKey | InChI | 1.03 | PFBPABKTMDMXDL-HXURKHJASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN1[C@H](N)C=CN([C@@H]2O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]2O)C1=O |
| SMILES | CACTVS | 3.385 | CCN1[CH](N)C=CN([CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH]2O)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN1C(C=CN(C1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCN1C(C=CN(C1=O)C2C(C(C(O2)COP(=O)(O)O)O)O)N |
