ARP
Summary
| Name: | 9-HYDROXYPROPYLADENINE, R-ISOMER |
| Formula: | C8 H11 N5 O |
| Formal charge: | 0 |
| Formula weight: | 193.206 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2R)-1-(6-amino-9H-purin-9-yl)propan-2-ol |
| OpenEye OEToolkits | 1.5.0 | (2R)-1-(6-aminopurin-9-yl)propan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c(c2ncn(c2nc1)CC(O)C)N |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](O)Cn1cnc2c(N)ncnc12 |
| SMILES | CACTVS | 3.341 | C[CH](O)Cn1cnc2c(N)ncnc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H](Cn1cnc2c1ncnc2N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(Cn1cnc2c1ncnc2N)O |
| InChI | InChI | 1.03 | InChI=1S/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | MJZYTEBKXLVLMY-RXMQYKEDSA-N |
