![2-Hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)-benzoyl His-Pro-Leu-Gly Dev](/api/spectrum/7OJpWAFRWCf/structure.png?h=300&w=458 "2-Hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)-benzoyl His-Pro-Leu-Gly Dev")
| SpectraBase Compound ID | 7qxWjhD5P2Q |
|---|---|
| InChI | InChI=1S/C34H39N9O9/c1-18(2)11-25(32(47)36-16-29(45)52-3)40-33(48)27-5-4-10-42(27)34(49)26(13-20-15-35-17-37-20)41-31(46)22-12-19(6-9-28(22)44)30-38-23-8-7-21(43(50)51)14-24(23)39-30/h6-9,12,14-15,17-18,25-27,44H,4-5,10-11,13,16H2,1-3H3,(H,35,37)(H,36,47)(H,38,39)(H,40,48)(H,41,46) |
| InChIKey | FOQCPXQLOJKIGL-UHFFFAOYSA-N |
| Mol Weight | 717.7 g/mol |
| Molecular Formula | C34H39N9O9 |
| Exact Mass | 717.287074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7OJpWAFRWCf |
|---|---|
| Name | 2-Hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)-benzoyl His-Pro-Leu-Gly Dev |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H39N9O9 |
| InChI | InChI=1S/C34H39N9O9/c1-18(2)11-25(32(47)36-16-29(45)52-3)40-33(48)27-5-4-10-42(27)34(49)26(13-20-15-35-17-37-20)41-31(46)22-12-19(6-9-28(22)44)30-38-23-8-7-21(43(50)51)14-24(23)39-30/h6-9,12,14-15,17-18,25-27,44H,4-5,10-11,13,16H2,1-3H3,(H,35,37)(H,36,47)(H,38,39)(H,40,48)(H,41,46) |
| InChIKey | FOQCPXQLOJKIGL-UHFFFAOYSA-N |
| Molecular Weight | 717.740 g/mol |
| SMILES | N(C(c1c(ccc(c1)-c1nc2ccc(N(=O)=O)cc2[nH]1)O)=O)C(Cc1c[nH]cn1)C(N1C(C(NC(C(NCC(=O)OC)=O)CC(C)C)=O)CCC1)=O |
| SPLASH | splash10-014i-9220513100-0ef255f9d6be039969be |
| Source of Spectrum | EMC-42-791-7g |
| Synonyms | Methyl 2-(2-(1-(2-(2-hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)benzamido)-3-(1H-imidazol-4-yl)propanoyl)pyrrolidine-2-carboxamido)-4-methylpentanamido)acetate |
| Wiley ID | 1735560 |