EP0/PRD_000310

CA030, ethyl ester of epoxysuccinyl-Ile-Pro-OH

EP0/PRD_000310 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 1CSB.

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Chemical Component Summary

NameCA030, ethyl ester of epoxysuccinyl-Ile-Pro-OH
Synonymsepoxy succinyl inhibitor
Identifiers(2S)-1-[(2S,3S)-2-[[(3R)-4-ethoxy-3-hydroxy-4-oxo-butanoyl]amino]-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid
FormulaC17 H28 N2 O7
Molecular Weight372.413
TypeNON-POLYMER
Isomeric SMILESCC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)C[C@H](C(=O)OCC)O
InChIInChI=1S/C17H28N2O7/c1-4-10(3)14(15(22)19-8-6-7-11(19)16(23)24)18-13(21)9-12(20)17(25)26-5-2/h10-12,14,20H,4-9H2,1-3H3,(H,18,21)(H,23,24)/t10-,11-,12+,14-/m0/s1
InChIKeyXMBVSOIOHZNPHI-FMSGJZPZSA-N
CompositionPolymer Sequences: 0A6-ILE-PRO
BIRD classINHIBITOR
Represented AsSINGLE MOLECULE
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count54
Chiral Atom Count4
Bond Count54
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 49866949