| SpectraBase Spectrum ID |
9X0wVQKrimW |
| Name |
L-Alanine, N-[N-[N-(2,4-dioxopentyl)-L-valyl]-L-isoleucyl]-, ethyl ester |
| Alternate Name(s) |
Ethyl (2S)-2-{[(2S,3S)-2-({(2S)-2-[(2,4-dioxopentyl)amino]-3-methylbutanoyl}amino)-3-methylpentanoyl]amino}propanoate |
| CAS Registry Number |
37580-34-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H37N3O6 |
| InChI |
InChI=1S/C21H37N3O6/c1-8-13(5)18(20(28)23-15(7)21(29)30-9-2)24-19(27)17(12(3)4)22-11-16(26)10-14(6)25/h12-13,15,17-18,22H,8-11H2,1-7H3,(H,23,28)(H,24,27)/t13-,15-,17-,18-/m0/s1 |
| InChIKey |
ICYOVNLMYOLIKU-IKICRFKJSA-N |
| Molecular Weight |
427.542 g/mol |
| SMILES |
N(C([C@@](NCC(CC(=O)C)=O)(C(C)C)[H])=O)[C@](C(N[C@](C(=O)OCC)(C)[H])=O)([C@](CC)(C)[H])[H] |
| SPLASH |
splash10-0udi-0900000000-63cdb9f4c7e2acedf0c4 |
| Source of Spectrum |
W5-34701-30835-30835 |
| Wiley ID |
1380364 |
![L-Alanine, N-[N-[N-(2,4-dioxopentyl)-L-valyl]-L-isoleucyl]-, ethyl ester](/api/spectrum/9X0wVQKrimW/structure.png?h=300&w=458 "L-Alanine, N-[N-[N-(2,4-dioxopentyl)-L-valyl]-L-isoleucyl]-, ethyl ester")
