| SpectraBase Spectrum ID |
JB3g2ALjTgk |
| Name |
O-dimethylaminobenzoylvalylisoleucylalanine ethyl ester |
| Alternate Name(s) |
Ethyl (2S)-2-{((2S,3S)-2-{[(2S)-2-amino-3-methylbutanoyl]amino}-3-methylpentanoyl)[2-(dimethylamino)benzoyl]amino}propanoate |
| CAS Registry Number |
58068-91-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H40N4O5 |
| InChI |
InChI=1S/C25H40N4O5/c1-9-16(5)21(27-22(30)20(26)15(3)4)24(32)29(17(6)25(33)34-10-2)23(31)18-13-11-12-14-19(18)28(7)8/h11-17,20-21H,9-10,26H2,1-8H3,(H,27,30)/t16-,17-,20-,21-/m0/s1 |
| InChIKey |
VLJBGJQUAUPDNX-USNOLKROSA-N |
| Molecular Weight |
476.618 g/mol |
| SMILES |
N([C@](C(N(C(c1c(N(C)C)cccc1)=O)[C@](C(=O)OCC)(C)[H])=O)([C@](CC)(C)[H])[H])C([C@@](N)(C(C)C)[H])=O |
| SPLASH |
splash10-0002-0951000000-c07d992d40e15a97b350 |
| Source of Spectrum |
O-10-693-3 |
| Wiley ID |
1394282 |
