TPL
Summary
Name: | TRYPTOPHANOL |
Synonyms: | 2-AMINO-3-(1H-INDOL-3-YL)-PROPAN-1-OL |
Formula: | C11 H14 N2 O |
Formal charge: | 0 |
Formula weight: | 190.242 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2S)-2-amino-3-(1H-indol-3-yl)propan-1-ol |
OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(1H-indol-3-yl)propan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCC(N)Cc2c1ccccc1nc2 |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@H](CO)Cc1c[nH]c2ccccc12 |
SMILES | CACTVS | 3.341 | N[CH](CO)Cc1c[nH]c2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)C[C@@H](CO)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(c[nH]2)CC(CO)N |
InChI | InChI | 1.03 | InChI=1S/C11H14N2O/c12-9(7-14)5-8-6-13-11-4-2-1-3-10(8)11/h1-4,6,9,13-14H,5,7,12H2/t9-/m0/s1 |
InChIKey | InChI | 1.03 | UDQCRUSSQAXPJY-VIFPVBQESA-N |