abequolixron (CHEBI:749077)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:749077 - abequolixron

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:749077
ChEBI Name	abequolixron
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C34H33ClF3NO3
Net Charge	0
Average Mass	596.089
Monoisotopic Mass	595.21011
SMILES	C[C@H](CCOc1cccc(CC(=O)O)c1)N(Cc1cccc(C(F)(F)F)c1Cl)CC(c1ccccc1)c1ccccc1
InChI	InChI=1S/C34H33ClF3NO3/c1-24(18-19-42-29-16-8-10-25(20-29)21-32(40)41)39(22-28-15-9-17-31(33(28)35)34(36,37)38)23-30(26-11-4-2-5-12-26)27-13-6-3-7-14-27/h2-17,20,24,30H,18-19,21-23H2,1H3,(H,40,41)/t24-/m1/s1
InChIKey	ZLJZDYOBXVOTSA-XMMPIXPASA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	abequolixron (CHEBI:749077) has role antineoplastic agent (CHEBI:35610)
	abequolixron (CHEBI:749077) is a diarylmethane (CHEBI:51614)

INN	Source
abequolixron	WHO MedNet

Synonyms	Source
RGX-104	ChEMBL
SB-742881	ChEMBL

Citations