| SpectraBase Compound ID | EKrDWYzfGYM |
|---|---|
| InChI | InChI=1S/C34H47N5O5/c1-8-44-34(43)29(18-22(4)5)38-33(42)28(19-23-20-35-26-15-11-9-13-24(23)26)37-32(41)27(17-21(2)3)36-31(40)25-14-10-12-16-30(25)39(6)7/h9-16,20-22,27-29,35H,8,17-19H2,1-7H3,(H,36,40)(H,37,41)(H,38,42) |
| InChIKey | BHYMONDGNILAEV-UHFFFAOYSA-N |
| Mol Weight | 605.8 g/mol |
| Molecular Formula | C34H47N5O5 |
| Exact Mass | 605.35772 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2BUXGrXEGLf |
|---|---|
| Name | O-dimethylaminobenzoylleucyltryptophylleucyl ethyl ester |
| Alternate Name(s) | Ethyl 2-{[2-[(2-{[2-(dimethylamino)benzoyl]amino}-4-methylpentanoyl)amino]-3-(1H-indol-3-yl)propanoyl]amino}-4-methylpentanoate |
| CAS Registry Number | 58068-94-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H47N5O5 |
| InChI | InChI=1S/C34H47N5O5/c1-8-44-34(43)29(18-22(4)5)38-33(42)28(19-23-20-35-26-15-11-9-13-24(23)26)37-32(41)27(17-21(2)3)36-31(40)25-14-10-12-16-30(25)39(6)7/h9-16,20-22,27-29,35H,8,17-19H2,1-7H3,(H,36,40)(H,37,41)(H,38,42) |
| InChIKey | BHYMONDGNILAEV-UHFFFAOYSA-N |
| Molecular Weight | 605.780 g/mol |
| SMILES | N(C(c1c(N(C)C)cccc1)=O)C(C(NC(Cc1c[nH]c2c1cccc2)C(NC(C(=O)OCC)CC(C)C)=O)=O)CC(C)C |
| SPLASH | splash10-000t-2930000000-19686c591dfbe4bb7275 |
| Source of Spectrum | O-10-695-4 |
| Wiley ID | 1410539 |