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CHEBI:759129 - afp-464

Default Structure
ChEBI IDCHEBI:759129
ChEBI Nameafp-464
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaCH4O3S.CH4O3S.C22H23F3N4O3
Net Charge0
Average Mass640.659
Monoisotopic Mass640.14846
SMILESCS(=O)(=O)O.CS(=O)(=O)O.Cc1c(F)c(N)c2c(=O)cc(-c3ccc(NC(=O)[C@@H](N)CCCCN)c(F)c3)oc2c1F
InChIInChI=1S/C22H23F3N4O3.2CH4O3S/c1-10-18(24)20(28)17-15(30)9-16(32-21(17)19(10)25)11-5-6-14(12(23)8-11)29-22(31)13(27)4-2-3-7-26;2*1-5(2,3)4/h5-6,8-9,13H,2-4,7,26-28H2,1H3,(H,29,31);2*1H3,(H,2,3,4)/t13-;;/m0../s1
InChIKeyFDQJDUBLCBZBCQ-GXKRWWSZSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
afp-464 (CHEBI:759129) has role antineoplastic agent (CHEBI:35610)
afp-464 (CHEBI:759129) is a flavonoids (CHEBI:72544)
Synonyms  Source
Afp 464ChEMBL
Afp-464ChEMBL
AFP464ChEMBL