CO9

1-({2-[(1S)-1-AMINOETHYL]-1,3-OXAZOL-4-YL}CARBONYL)-L-PROLYL-L-TRYPTOPHAN


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Chemical Component Summary

Name1-({2-[(1S)-1-AMINOETHYL]-1,3-OXAZOL-4-YL}CARBONYL)-L-PROLYL-L-TRYPTOPHAN
Identifiers(2S)-2-[[(2S)-1-[[2-[(1S)-1-aminoethyl]-1,3-oxazol-4-yl]carbonyl]pyrrolidin-2-yl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid
FormulaC22 H25 N5 O5
Molecular Weight439.464
TypeNON-POLYMER
Isomeric SMILESC[C@@H](c1nc(co1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3c[nH]c4c3cccc4)C(=O)O)N
InChIInChI=1S/C22H25N5O5/c1-12(23)20-26-17(11-32-20)21(29)27-8-4-7-18(27)19(28)25-16(22(30)31)9-13-10-24-15-6-3-2-5-14(13)15/h2-3,5-6,10-12,16,18,24H,4,7-9,23H2,1H3,(H,25,28)(H,30,31)/t12-,16-,18-/m0/s1
InChIKeyFBRCDLGEWAXPMI-IWEFOYFVSA-N

Chemical Details

Formal Charge0
Atom Count57
Chiral Atom Count3
Bond Count60
Aromatic Bond Count15

Related Resource References

Resource NameReference
PubChem 24916924, 15991584
ChEMBL CHEMBL393164