GGB
Summary
| Name: | L-CANAVANINE |
| Synonyms: | L-2-AMINO-4-(GUANIDINOOXY)BUTYRIC ACID |
| Formula: | C5 H12 N4 O3 |
| Formal charge: | 0 |
| Formula weight: | 176.174 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | O-carbamimidamido-L-homoserine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-4-carbamimidamidooxy-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)CCONC(=[N@H])N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CCONC(N)=N)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](CCONC(N)=N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [H]/N=C(\N)/NOCC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | [H]N=C(N)NOCCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-12-9-5(7)8/h3H,1-2,6H2,(H,10,11)(H4,7,8,9)/t3-/m0/s1 |
| InChIKey | InChI | 1.03 | FSBIGDSBMBYOPN-VKHMYHEASA-N |
