SpectraBase Compound ID | CccDiqDrAtK |
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InChI | InChI=1S/C22H21N5O7/c1-11(22(31)32)23-20(29)17-3-2-8-26(17)21(30)14-9-12(4-7-18(14)28)19-24-15-6-5-13(27(33)34)10-16(15)25-19/h4-7,9-11,17,28H,2-3,8H2,1H3,(H,23,29)(H,24,25)(H,31,32) |
InChIKey | MRSUJYSMUJQIDN-UHFFFAOYSA-N |
Mol Weight | 467.44 g/mol |
Molecular Formula | C22H21N5O7 |
Exact Mass | 467.144098 g/mol |
SpectraBase Spectrum ID | 67mzDoELEF8 |
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Name | 2-Hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)-benzoyl Pro-Ala-dev |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C22H21N5O7 |
InChI | InChI=1S/C22H21N5O7/c1-11(22(31)32)23-20(29)17-3-2-8-26(17)21(30)14-9-12(4-7-18(14)28)19-24-15-6-5-13(27(33)34)10-16(15)25-19/h4-7,9-11,17,28H,2-3,8H2,1H3,(H,23,29)(H,24,25)(H,31,32) |
InChIKey | MRSUJYSMUJQIDN-UHFFFAOYSA-N |
Molecular Weight | 467.438 g/mol |
SMILES | N(C(C1N(C(c2c(ccc(c2)-c2nc3ccc(N(=O)=O)cc3[nH]2)O)=O)CCC1)=O)C(C(=O)O)C |
SPLASH | splash10-004i-5349200000-6d789c77ce49b2565e2d |
Source of Spectrum | EMC-42-795-7da |
Synonyms | 2-(1-(2-hydroxy-5-(6-nitro-1H-benzo[d]imidazol-2-yl)benzoyl)pyrrolidine-2-carboxamido)propanoic acid |
Wiley ID | 1735554 |