M7A
Summary
| Name: | 7-methyl, adenosine-5'-monophosphate |
| Formula: | C11 H18 N5 O7 P |
| Formal charge: | 0 |
| Formula weight: | 363.264 Da |
| Component type: | RNA linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [(2~{R},3~{S},4~{R},5~{R})-5-(6-azanyl-7-methyl-8~{H}-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H18N5O7P/c1-15-4-16(10-6(15)9(12)13-3-14-10)11-8(18)7(17)5(23-11)2-22-24(19,20)21/h3,5,7-8,11,17-18H,2,4H2,1H3,(H2,12,13,14)(H2,19,20,21)/t5-,7-,8-,11-/m1/s1 |
| InChIKey | InChI | 1.03 | FKHMVBQIIIBSCT-IOSLPCCCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CN([C@@H]2O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]2O)c3ncnc(N)c13 |
| SMILES | CACTVS | 3.385 | CN1CN([CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH]2O)c3ncnc(N)c13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN1CN(c2c1c(ncn2)N)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CN1CN(c2c1c(ncn2)N)C3C(C(C(O3)COP(=O)(O)O)O)O |
