2UL

3-[(2R)-2-{[(2R)-2-amino-2-phenylacetyl]amino}-2-(dihydroxyboranyl)ethyl]benzoic acid


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Chemical Component Summary

Name3-[(2R)-2-{[(2R)-2-amino-2-phenylacetyl]amino}-2-(dihydroxyboranyl)ethyl]benzoic acid
Identifiers3-[(2R)-2-[[(2R)-2-azanyl-2-phenyl-ethanoyl]amino]-2-(dihydroxyboranyl)ethyl]benzoic acid
FormulaC17 H19 B N2 O5
Molecular Weight342.154
TypeNON-POLYMER
Isomeric SMILESB([C@H](Cc1cccc(c1)C(=O)O)NC(=O)[C@@H](c2ccccc2)N)(O)O
InChIInChI=1S/C17H19BN2O5/c19-15(12-6-2-1-3-7-12)16(21)20-14(18(24)25)10-11-5-4-8-13(9-11)17(22)23/h1-9,14-15,24-25H,10,19H2,(H,20,21)(H,22,23)/t14-,15+/m0/s1
InChIKeyWMZXFYUXEUIIHA-LSDHHAIUSA-N

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count2
Bond Count45
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 71562534
ChEMBL CHEMBL2326847