![5-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-2-hydroxybenzoyl Ala-Val-Ala Dev](/api/spectrum/EzhXD2YmyyK/structure.png?h=300&w=458 "5-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-2-hydroxybenzoyl Ala-Val-Ala Dev")
| SpectraBase Compound ID | En5DVG2hYCH |
|---|---|
| InChI | InChI=1S/C27H33N5O6/c1-12(2)22(26(36)29-16(6)27(37)38)32-24(34)15(5)28-25(35)18-11-17(7-8-21(18)33)23-30-19-9-13(3)14(4)10-20(19)31-23/h7-12,15-16,22,33H,1-6H3,(H,28,35)(H,29,36)(H,30,31)(H,32,34)(H,37,38) |
| InChIKey | MCGRAPOFZAAXAV-UHFFFAOYSA-N |
| Mol Weight | 523.6 g/mol |
| Molecular Formula | C27H33N5O6 |
| Exact Mass | 523.243084 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EzhXD2YmyyK |
|---|---|
| Name | 5-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-2-hydroxybenzoyl Ala-Val-Ala Dev |
| Alternate Name(s) | 2-(2-(2-(5-(5,6-dimethyl-1H-benzo[d]imidazol-2-yl)-2-hydroxybenzamido)propanamido)-3-methylbutanamido)propanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H33N5O6 |
| InChI | InChI=1S/C27H33N5O6/c1-12(2)22(26(36)29-16(6)27(37)38)32-24(34)15(5)28-25(35)18-11-17(7-8-21(18)33)23-30-19-9-13(3)14(4)10-20(19)31-23/h7-12,15-16,22,33H,1-6H3,(H,28,35)(H,29,36)(H,30,31)(H,32,34)(H,37,38) |
| InChIKey | MCGRAPOFZAAXAV-UHFFFAOYSA-N |
| Molecular Weight | 523.590 g/mol |
| SMILES | [nH]1c2cc(c(cc2nc1-c1cc(c(cc1)O)C(NC(C(NC(C(NC(C(=O)O)C)=O)C(C)C)=O)C)=O)C)C |
| SPLASH | splash10-000i-5239310000-0d7679d2c4fcbe88d0c0 |
| Source of Spectrum | EMC-42-795-8fa |
| Wiley ID | 1734303 |