OntologieschebiclassesCHEBI:137236   
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ilomastat
http://purl.obolibrary.org/obo/CHEBI_137236

An N-acyl-amino acid obtained by formal condensation of the carboxy group of (2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoic acid with the amino group of N-methyl-L-tryptophanamide. A cell permeable broad-spectrum matrix metalloproteinase (MMP) inhibitor

Also appears inslm
Exact Synonyms
(2R)-N(4)-hydroxy-N(1)-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide
Related Synonyms
CS 610
galardin
GM 6001
GM-6001
GM6001
ilomastat
class Information
charge

0

formula

C20H28N4O4

has_alternative_id

CHEBI_42919

has_obo_namespace

chebi_ontology

inchikey

NITYDPDXAAFEIT-DYVFJYSZSA-N

inchi

InChI=1S/C20H28N4O4/c1-12(2)8-13(10-18(25)24-28)19(26)23-17(20(27)21-3)9-14-11-22-16-7-5-4-6-15(14)16/h4-7,11-13,17,22,28H,8-10H2,1-3H3,(H,21,27)(H,23,26)(H,24,25)/t13-,17+/m1/s1

in_subset

3_STAR

mass

388.461

monoisotopicmass

388.21106

smiles

C(C(NO)=O)[C@H](C(N[C@H](C(NC)=O)CC=1C=2C(NC1)=CC=CC2)=O)CC(C)C

class Relations