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CHEBI:233417 - Omilancor

Default Structure
ChEBI IDCHEBI:233417
ChEBI NameOmilancor
Stars
DefinitionOmilancor (BT-11) is an orally active lanthionine synthetase C-like 2 (LANCL2) binding compound for treating inflammatory bowel disease (IBD) (Kd value of 7.7 uM).
Submitterlbonaobra
DownloadsMolfile
FormulaC30H24N8O2
Net Charge0
Average Mass528.576
Monoisotopic Mass528.20222
SMILESO=C(c1cccc(-c2nc3ccccc3n2)n1)N1CCN(C(=O)c2cccc(-c3nc4ccccc4n3)n2)CC1
InChIInChI=1S/C30H24N8O2/c39-29(25-13-5-11-23(31-25)27-33-19-7-1-2-8-20(19)34-27)37-15-17-38(18-16-37)30(40)26-14-6-12-24(32-26)28-35-21-9-3-4-10-22(21)36-28/h1-14H,15-18H2,(H,33,34)(H,35,36)
InChIKeyMVHWZNBAQIGPOQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Omilancor (CHEBI:233417) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
1912399-75-7SUBMITTER
[4-[6-(1H-benzimidazol-2-yl)pyridine-2-carbonyl]piperazin-1-yl]-[6-(1H-benzimidazol-2-yl)pyridin-2-yl]methanoneSUBMITTER
BT-11SUBMITTER
Registry NumbersSources
CAS:1912399-75-7SUBMITTER