Terminology Service for NFDI4Health
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bortezomib

Go to external page http://purl.obolibrary.org/obo/CHEBI_52717

L-Phenylalaninamide substituted at the amide nitrogen by a 1-(dihydroxyboranyl)-3-methylbutyl group and at N(alpha) by a pyrazin-2-ylcarbonyl group. It is a dipeptidyl boronic acid that reversibly inhibits the 26S proteasome.

Term info

Label

bortezomib

Synonyms
  • N-[(1R)-1-(dihydroxyboranyl)-3-methylbutyl]-N(alpha)-(pyrazin-2-ylcarbonyl)-L-phenylalaninamide
  • [(1R)-3-methyl-1-({(2S)-3-phenyl-2-[(pyrazin-2-ylcarbonyl)amino]propanoyl}amino)butyl]boronic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
[(1R)-3-methyl-1-({(2S)-3-phenyl-2-[(pyrazin-2-ylcarbonyl)amino]propanoyl}amino)butyl]boronic acid [ IUPAC ]

BRAND NAME
Velcade [ DrugBank ]

IUPAC NAME
N-[(1R)-1-(dihydroxyboranyl)-3-methylbutyl]-N(alpha)-(pyrazin-2-ylcarbonyl)-L-phenylalaninamide [ IUPAC ]

INN
bortezomib [ ChemIDplus ]

charge

0

formula

C19H25BN4O4

has alternative id

CHEBI:41143

has obo namespace

chebi_ontology

has related synonym

N-[(1R)-1-(DIHYDROXYBORYL)-3-METHYLBUTYL]-N-(PYRAZIN-2-YLCARBONYL)-L-PHENYLALANINAMIDE, PS 341, PS-341, bortezomib, Velcade

id

CHEBI:52717

inchi

InChI=1S/C19H25BN4O4/c1-13(2)10-17(20(27)28)24-18(25)15(11-14-6-4-3-5-7-14)23-19(26)16-12-21-8-9-22-16/h3-9,12-13,15,17,27-28H,10-11H2,1-2H3,(H,23,26)(H,24,25)/t15-,17-/m0/s1

inchikey

GXJABQQUPOEUTA-RDJZCZTQSA-N

mass

384.23700

monoisotopicmass

384.19689

smiles

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O