sepantronium bromide (CHEBI:139608)

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ChEBI Name	sepantronium bromide

ChEBI ID	CHEBI:139608

Definition	An organic bromide salt consisting of sepantronium cations and bromide anions. It has been found to selectively inhibit survivin (BIRC5) gene promoter activity and to down-regulate survivin in vitro, so leading to induction of apoptosis.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C20H19BrN4O3

Net Charge

Average Mass

443.294

Monoisotopic Mass

442.06405

InChI

InChI=1S/C20H19N4O3.BrH/c1-13-23(9-10-27-2)17-18(24(13)12-14-11-21-7-8-22-14)20(26)16-6-4-3-5-15(16)19(17)25;/h3-8,11H,9-10,12H2,1-2H3;1H/q+1;/p-1

InChIKey

QBIYUDDJPRGKNJ-UHFFFAOYSA-M

SMILES

[Br-].C1=CC=CC2=C1C(C=3N(C(=[N+](C3C2=O)CC=4N=CC=NC4)C)CCOC)=O

Roles Classification
Biological Role(s):	survivin suppressant An apoptosis inducer that works by selectively inhibiting survivin (BIRC5) gene promoter activity so as to down-regulate survivin, a protein that inhibits apoptosis, so leading to induction of apoptosis. apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	sepantronium bromide (CHEBI:139608) has part sepantronium (CHEBI:94552) sepantronium bromide (CHEBI:139608) has role antineoplastic agent (CHEBI:35610) sepantronium bromide (CHEBI:139608) has role apoptosis inducer (CHEBI:68495) sepantronium bromide (CHEBI:139608) has role survivin suppressant (CHEBI:139609) sepantronium bromide (CHEBI:139608) is a organic bromide salt (CHEBI:48369)

IUPAC Name

1-(2-methoxyethyl)-2-methyl-4,9-dioxo-3-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide

Synonyms	Sources
3-(2-methoxyethyl)-2-methyl-4,9-dioxo-1-(pyrazin-2-ylmethyl)-4,9-dihydro-1H-naphtho[2,3-d]imidazol-3-ium bromide	IUPAC
YM 155	ChemIDplus
YM-155	ChemIDplus

Registry Number	Type	Source
781661-94-7	CAS Registry Number	ChemIDplus

Last Modified

07 February 2018