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948294-96-0 | Des-pyrazinecarboxaldehydeBortezomib
CAS No: 948294-96-0 Catalog No: AG01E60K MDL No:
Product Description
Catalog Number:
AG01E60K
Chemical Name:
Des-pyrazinecarboxaldehydeBortezomib
CAS Number:
948294-96-0
IUPAC Name:
[(1R)-1-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutyl]boronic acid
InChI:
InChI=1S/C14H23BN2O3/c1-10(2)8-13(15(19)20)17-14(18)12(16)9-11-6-4-3-5-7-11/h3-7,10,12-13,19-20H,8-9,16H2,1-2H3,(H,17,18)/t12-,13-/m0/s1
InChI Key:
HCSFPFDGDYVJDD-STQMWFEESA-N
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
278.18g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
278.159g/mol
Monoisotopic Mass:
278.18g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| A high-throughput, multiplexed assay for superfamily-wide profiling of enzyme activity. | Nature chemical biology 20140801 |
| Chemical and biological evaluation of dipeptidyl boronic acid proteasome inhibitors for use in prodrugs and pro-soft drugs targeting solid tumors. | Journal of medicinal chemistry 20110714 |
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