| SpectraBase Spectrum ID |
3E4PA2UU8KQ |
| Name |
N-(2-Chloro-3-phenylpropionyl)-L-tryptophan methyl ester |
| Alternate Name(s) |
Methyl (2S)-2-[(2-chloro-3-phenylpropanoyl)amino]-3-(1H-indol-3-yl)propanoate
N-(-2-Chloro-3-phenylpropionyl)tryptophan methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21ClN2O3 |
| InChI |
InChI=1S/C21H21ClN2O3/c1-27-21(26)19(12-15-13-23-18-10-6-5-9-16(15)18)24-20(25)17(22)11-14-7-3-2-4-8-14/h2-10,13,17,19,23H,11-12H2,1H3,(H,24,25)/t17?,19-/m0/s1 |
| InChIKey |
FUKHXWIYMMAZST-NNBQYGFHSA-N |
| Molecular Weight |
384.863 g/mol |
| SMILES |
[nH]1c2c(c(C[C@](NC(C(Cc3ccccc3)Cl)=O)(C(=O)OC)[H])c1)cccc2 |
| SPLASH |
splash10-001i-3910000000-783a0935dd25007cc8a2 |
| Source of Spectrum |
KC-1992-808-37 |
| Wiley ID |
776269 |
