OJY
Summary
| Name: | 5-[5-(hydroxymethyl)-1H-imidazol-2-yl]-L-norvaline |
| Formula: | C9 H15 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 213.234 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-[5-(hydroxymethyl)-1H-imidazol-2-yl]-L-norvaline |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-5-[5-(hydroxymethyl)-1~{H}-imidazol-2-yl]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(c1nc(CO)cn1)CCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C9H15N3O3/c10-7(9(14)15)2-1-3-8-11-4-6(5-13)12-8/h4,7,13H,1-3,5,10H2,(H,11,12)(H,14,15)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | LQZCDDAMPJTCPF-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CCCc1[nH]c(CO)cn1)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CCCc1[nH]c(CO)cn1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c([nH]c(n1)CCC[C@@H](C(=O)O)N)CO |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c([nH]c(n1)CCCC(C(=O)O)N)CO |
