| SpectraBase Compound ID | 1Pto9TBpEcZ |
|---|---|
| InChI | InChI=1S/C16H29N3O5/c1-8(2)7-12(18-11(6)20)14(21)19-13(9(3)4)15(22)17-10(5)16(23)24/h8-10,12-13H,7H2,1-6H3,(H,17,22)(H,18,20)(H,19,21)(H,23,24)/t10-,12-,13-/m0/s1 |
| InChIKey | HHBZVVOYRZYUEW-DRZSPHRISA-N |
| Mol Weight | 343.42 g/mol |
| Molecular Formula | C16H29N3O5 |
| Exact Mass | 343.210721 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ADYN3rTgE6S |
|---|---|
| Name | Acetyl-leu-ual-ala-hydroxyl |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H29N3O5 |
| InChI | InChI=1S/C16H29N3O5/c1-8(2)7-12(18-11(6)20)14(21)19-13(9(3)4)15(22)17-10(5)16(23)24/h8-10,12-13H,7H2,1-6H3,(H,17,22)(H,18,20)(H,19,21)(H,23,24)/t10-,12-,13-/m0/s1 |
| InChIKey | HHBZVVOYRZYUEW-DRZSPHRISA-N |
| Molecular Weight | 343.424 g/mol |
| SMILES | N([C@](C(N[C@](C(=O)O)(C)[H])=O)(C(C)C)[H])C([C@@](NC(=O)C)(CC(C)C)[H])=O |
| SPLASH | splash10-00g3-9100000000-e505d61aef8b76b7d42c |
| Source of Spectrum | CG-4-231-67 |
| Synonyms | (2S)-2-[((2S)-2-{[(2S)-2-(acetylamino)-4-methylpentanoyl]amino}-3-methylbutanoyl)amino]propanoic acid N-acetyl-leucyl-valyl-alanine |
| Wiley ID | 1337187 |