etc-159 (CHEBI:755665)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:755665 - etc-159

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:755665
ChEBI Name	etc-159
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C19H17N7O3
Net Charge	0
Average Mass	391.391
Monoisotopic Mass	391.13929
SMILES	Cn1c(=O)c2c(ncn2CC(=O)Nc2ccc(-c3ccccc3)nn2)n(C)c1=O
InChI	InChI=1S/C19H17N7O3/c1-24-17-16(18(28)25(2)19(24)29)26(11-20-17)10-15(27)21-14-9-8-13(22-23-14)12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H,21,23,27)
InChIKey	QTRXIFVSTWXRJJ-UHFFFAOYSA-N

Roles Classification

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology

Outgoing Relation(s)
	etc-159 (CHEBI:755665) has role antineoplastic agent (CHEBI:35610)
	etc-159 (CHEBI:755665) is a pyridazines (CHEBI:37921)
	etc-159 (CHEBI:755665) is a ring assembly (CHEBI:36820)

Synonyms	Source
Etc-159	ChEMBL
Etc-1922159	ChEMBL

Citations