TRX
Summary
Name: | 6-HYDROXYTRYPTOPHAN |
Formula: | C11 H12 N2 O3 |
Formal charge: | 0 |
Formula weight: | 220.225 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 6-hydroxy-L-tryptophan |
OpenEye OEToolkits | 1.7.2 | (2S)-2-azanyl-3-(6-oxidanyl-1H-indol-3-yl)propanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(N)Cc2c1ccc(O)cc1nc2 |
InChI | InChI | 1.03 | InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-4-7(14)1-2-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1 |
InChIKey | InChI | 1.03 | NXANGIZFHQQBCC-VIFPVBQESA-N |
SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](Cc1c[nH]c2cc(O)ccc12)C(O)=O |
SMILES | CACTVS | 3.370 | N[CH](Cc1c[nH]c2cc(O)ccc12)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1cc2c(cc1O)[nH]cc2C[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.7.2 | c1cc2c(cc1O)[nH]cc2CC(C(=O)O)N |