PRD_002174
Bound inhibitor of N-(tert-butoxycarbonyl)-L-seryl-L-valyl-N-{(2S)-5-ethoxy-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]pentan-2-yl}-L-leucinamide
PRD_002174 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).
The representative PDB ID is 4ZRO.
Chemical Component Summary | |
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Name | Bound inhibitor of N-(tert-butoxycarbonyl)-L-seryl-L-valyl-N-{(2S)-5-ethoxy-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]pentan-2-yl}-L-leucinamide |
Identifiers | ethyl (4R)-4-[[(2S)-4-methyl-2-[[(2S)-3-methyl-2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoyl]amino]butanoyl]amino]pentanoyl]amino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pentanoate |
Formula | C30 H53 N5 O9 |
Molecular Weight | 627.77 |
Type | PEPTIDE-LIKE |
Isomeric SMILES | CCOC(=O)CC[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)OC(C)(C)C |
InChI | InChI=1S/C30H53N5O9/c1-9-43-23(37)11-10-20(15-19-12-13-31-25(19)38)32-26(39)21(14-17(2)3)33-28(41)24(18(4)5)35-27(40)22(16-36)34-29(42)44-30(6,7)8/h17-22,24,36H,9-16H2,1-8H3,(H,31,38)(H,32,39)(H,33,41)(H,34,42)(H,35,40)/t19-,20+,21-,22-,24-/m0/s1 |
InChIKey | MBFUEQBSSRAWAF-ZMNKMHGQSA-N |
Composition | Polymer Sequences: BOC-SER-VAL-LEU-CEV |
BIRD class | INHIBITOR |
Represented As | POLYMER |
Compound Details | n/a |
Description | n/a |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 97 |
Chiral Atom Count | 5 |
Bond Count | 97 |
Aromatic Bond Count | 0 |