PRD_000414

Meo-Suc-Ala-Ala-Pro-Val-chloromethyl ketone

PRD_000414 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 1PPG.

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Chemical Component Summary
Name	Meo-Suc-Ala-Ala-Pro-Val-chloromethyl ketone
Identifiers	(2S)-N-[(3S)-1-chloranyl-4-methyl-2-oxidanyl-pentan-3-yl]-1-[(2S)-2-[[(2S)-2-[(4-methoxy-4-oxidanyl-butanoyl)amino]propanoyl]amino]propanoyl]pyrrolidine-2-carboxamide
Formula	C₂₂ H₃₉ Cl N₄ O₇
Molecular Weight	507.021
Type	PEPTIDE-LIKE
Isomeric SMILES	C[C@@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(CCl)O)NC(=O)CCC(O)OC
InChI	InChI=1S/C22H39ClN4O7/c1-12(2)19(16(28)11-23)26-21(32)15-7-6-10-27(15)22(33)14(4)25-20(31)13(3)24-17(29)8-9-18(30)34-5/h12-16,18-19,28,30H,6-11H2,1-5H3,(H,24,29)(H,25,31)(H,26,32)/t13-,14-,15?,16?,18?,19-/m0/s1
InChIKey	FVDKKBYCSINGBW-DIAJEADNSA-N
Composition	Polymer Sequences: HMB-ALA-ALA-PRO-VAI-0QE
BIRD class	INHIBITOR
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	73
Chiral Atom Count	5
Bond Count	73
Aromatic Bond Count	0

RCSB PDB Core Operations are funded by the National Science Foundation (DBI-1832184), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM133198.