| SpectraBase Spectrum ID |
LHexDhbs2be |
| Name |
L-Phenylalaninamide, N-[[4-(dimethylamino)phenyl]methylene]-L-tryptophyl-L-methionyl-L-.alpha.-aspartyl-, ethyl ester |
| Alternate Name(s) |
Ethyl 4-[(2-amino-1-benzyl-2-oxoethyl)amino]-3-([2-([2-(((E)-[4-(dimethylamino)phenyl]methylidene)amino)-3-(1H-indol-3-yl)propanoyl]amino)-4-(methylsulfanyl)butanoyl]amino)-4-oxobutanoate |
| CAS Registry Number |
40760-02-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H49N7O6S |
| InChI |
InChI=1S/C40H49N7O6S/c1-5-53-36(48)23-35(40(52)45-33(37(41)49)21-26-11-7-6-8-12-26)46-38(50)32(19-20-54-4)44-39(51)34(22-28-25-43-31-14-10-9-13-30(28)31)42-24-27-15-17-29(18-16-27)47(2)3/h6-18,24-25,32-35,43H,5,19-23H2,1-4H3,(H2,41,49)(H,44,51)(H,45,52)(H,46,50)/b42-24+ |
| InChIKey |
AZCCYYUNOKYWHO-HAPYPFFUSA-N |
| Molecular Weight |
755.935 g/mol |
| SMILES |
N(C(C(=O)NC(C(N)=O)Cc1ccccc1)CC(OCC)=O)C(C(CCSC)NC(C(Cc1c[nH]c2ccccc12)\N=C\c1ccc(cc1)N(C)C)=O)=O |
| SPLASH |
splash10-03dr-0592101000-40f0d7ae1f78bb6c5e03 |
| Source of Spectrum |
O7-0-817-0 |
| Wiley ID |
1416427 |
![L-Phenylalaninamide, N-[[4-(dimethylamino)phenyl]methylene]-L-tryptophyl-L-methionyl-L-.alpha.-aspartyl-, ethyl ester](/api/spectrum/LHexDhbs2be/structure.png?h=300&w=458 "L-Phenylalaninamide, N-[[4-(dimethylamino)phenyl]methylene]-L-tryptophyl-L-methionyl-L-.alpha.-aspartyl-, ethyl ester")
