TRF
Summary
| Name: | N1-FORMYL-TRYPTOPHAN |
| Formula: | C12 H12 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 232.235 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-formyl-L-tryptophan |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(1-methanoylindol-3-yl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)Cc2c1ccccc1n(c2)C=O |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1cn(C=O)c2ccccc12)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](Cc1cn(C=O)c2ccccc12)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(cn2C=O)C[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(cn2C=O)CC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O3/c13-10(12(16)17)5-8-6-14(7-15)11-4-2-1-3-9(8)11/h1-4,6-7,10H,5,13H2,(H,16,17)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | KRUDZOGZZBVSHD-JTQLQIEISA-N |
