APM
Summary
| Name: | M-AMIDINOPHENYL-3-ALANINE |
| Formula: | C10 H13 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 207.229 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-carbamimidoyl-L-phenylalanine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(3-carbamimidoylphenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)Cc1cc(ccc1)C(=[N@H])N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1cccc(c1)C(N)=N)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](Cc1cccc(c1)C(N)=N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)C(=N)N)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)C(=N)N)CC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C10H13N3O2/c11-8(10(14)15)5-6-2-1-3-7(4-6)9(12)13/h1-4,8H,5,11H2,(H3,12,13)(H,14,15)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | NIOKQPJRXDRREF-QMMMGPOBSA-N |
