[2-[[(2S,3S,4R)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-3,4-bis(oxidanyl)pyrrolidin-1-yl]methyl]phenyl]boronic acid

Systemtic Name: [2-[[(2S,3S,4R)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-3,4-bis(oxidanyl)pyrrolidin-1-yl]methyl]phenyl]boronic acid Openeye Name: [2-[[(2S,3S,4R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-pyrrolidin-1-yl]methyl]phenyl]boronic acid CAS Name: [2-[[(2S,3S,4R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-1-pyrrolidinyl]methyl]phenyl]boronic acid IUPAC Name: [2-[[(2S,3S,4R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxypyrrolidin-1-yl]methyl]phenyl]boronic acid Traditional Name: [2-[[(2S,3S,4R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-pyrrolidino]methyl]phenyl]boronic acid Formula: C13H20BNO6 MolecularWeight: 297.112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1CN2CC(C(C2C(CO)O)O)O)(O)O

Isomeric SMILES

B(C1=CC=CC=C1CN2C[C@H]([C@H]([C@@H]2[C@@H](CO)O)O)O)(O)O

InChI

InChI=1S/C13H20BNO6/c16-7-11(18)12-13(19)10(17)6-15(12)5-8-3-1-2-4-9(8)14(20)21/h1-4,10-13,16-21H,5-7H2/t10-,11-,12+,13-/m1/s1