| SpectraBase Spectrum ID |
BEuxFtPZal8 |
| Name |
(S)-methyl 2-((S)-2-((Z)-2-((S)-3-isopropyl-1-oxo-2,3-dihydroisoquinolin-4(1H)-ylidene)acetamido)-4-methylpentanamido)propanoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H33N3O5 |
| InChI |
InChI=1S/C24H33N3O5/c1-13(2)11-19(23(30)25-15(5)24(31)32-6)26-20(28)12-18-16-9-7-8-10-17(16)22(29)27-21(18)14(3)4/h7-10,12-15,19,21H,11H2,1-6H3,(H,25,30)(H,26,28)(H,27,29)/b18-12-/t15-,19-,21-/m0/s1 |
| InChIKey |
RQNDSGUSUPOXTF-WRERPWHSSA-N |
| Literature Reference DOI |
10.1002_1615-4169(200209)344_8_855 |
| Molecular Weight |
443.544 g/mol |
| SMILES |
N(C(\C=C\1c2ccccc2C(=O)N[C@]1(C(C)C)[H])=O)[C@](C(N[C@](C(=O)OC)(C)[H])=O)(CC(C)C)[H] |
| SPLASH |
splash10-004i-0290100000-fa65be79eeb6b8326161 |
| Source of Spectrum |
ASC-344-860-8 |
| Synonyms |
(2S)-2-[[(2S)-4-methyl-1-oxo-2-[[(2Z)-1-oxo-2-[(3S)-1-oxo-3-propan-2-yl-2,3-dihydroisoquinolin-4-ylidene]ethyl]amino]pentyl]amino]propanoic acid methyl ester
Methyl (2S)-2-[[(2S)-4-methyl-2-[[(2Z)-2-[(3S)-1-oxo-3-propan-2-yl-2,3-dihydroisoquinolin-4-ylidene]acetyl]amino]pentanoyl]amino]propanoate
Methyl (2S)-2-[[(2S)-2-[[(2Z)-2-[(3S)-3-isopropyl-1-oxo-2,3-dihydroisoquinolin-4-ylidene]acetyl]amino]-4-methyl-pentanoyl]amino]propanoate
Methyl (2S)-2-[[(2S)-4-methyl-2-[[(2Z)-2-[(3S)-1-oxidanylidene-3-propan-2-yl-2,3-dihydroisoquinolin-4-ylidene]ethanoyl]amino]pentanoyl]amino]propanoate |
| Wiley ID |
1767326 |
