SpectraBase Compound ID | 50hol8o2iz6 |
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InChI | InChI=1S/C26H25N3O7S/c1-35-26(32)22(13-15-37-2)28-24(30)18-7-9-19(10-8-18)27-25(31)21(23-4-3-14-36-23)16-17-5-11-20(12-6-17)29(33)34/h3-12,14,16,22H,13,15H2,1-2H3,(H,27,31)(H,28,30)/b21-16+ |
InChIKey | CNZDQUNYILAHMX-LTGZKZEYSA-N |
Mol Weight | 523.56 g/mol |
Molecular Formula | C26H25N3O7S |
Exact Mass | 523.141321 g/mol |
SpectraBase Spectrum ID | 4lBYOsvytG5 |
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Name | N-{4'-[3"-(5"'-(p-Nitrophenyl)-2"'-furyl]-acryloylamino]benzoyl}-methionine - Methyl Ester |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C26H25N3O7S |
InChI | InChI=1S/C26H25N3O7S/c1-35-26(32)22(13-15-37-2)28-24(30)18-7-9-19(10-8-18)27-25(31)21(23-4-3-14-36-23)16-17-5-11-20(12-6-17)29(33)34/h3-12,14,16,22H,13,15H2,1-2H3,(H,27,31)(H,28,30)/b21-16+ |
InChIKey | CNZDQUNYILAHMX-LTGZKZEYSA-N |
Molecular Weight | 523.560 g/mol |
SMILES | N(C(\C(c1occc1)=C\c1ccc(N(=O)=O)cc1)=O)c1ccc(C(NC(C(=O)OC)CCSC)=O)cc1 |
SPLASH | splash10-022c-0290040000-92b7daf50d46c00935af |
Source of Spectrum | D9-335-141-9 |
Wiley ID | 1550944 |