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CHEBI:759878 - abbv-467

Default Structure
ChEBI IDCHEBI:759878
ChEBI Nameabbv-467
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC53H51Cl2FN6O9S
Net Charge0
Average Mass1037.995
Monoisotopic Mass1036.27993
SMILESCc1c(Cl)c2c(Cl)c(C)c1-c1c(-c3ccc(F)cc3)sc3ncnc(c13)O[C@@H](C(=O)O)Cc1cc(ccc1OCc1ccnc(-c3ccc(OC[C@H]4COCCO4)cc3)n1)OC[C@@H](CN1CCN(C)CC1)O2
InChIInChI=1S/C53H51Cl2FN6O9S/c1-30-43-31(2)47(55)48(46(30)54)70-39(24-62-18-16-61(3)17-19-62)27-68-38-12-13-41(69-25-36-14-15-57-50(60-36)33-6-10-37(11-7-33)67-28-40-26-65-20-21-66-40)34(22-38)23-42(53(63)64)71-51-45-44(43)49(72-52(45)59-29-58-51)32-4-8-35(56)9-5-32/h4-15,22,29,39-40,42H,16-21,23-28H2,1-3H3,(H,63,64)/t39-,40-,42-/m1/s1
InChIKeyBOMNURVTAHAEBQ-KWIIHVIGSA-N
ChEBI Ontology
Outgoing Relation(s)
abbv-467 (CHEBI:759878) is a organic heterobicyclic compound (CHEBI:27171)
abbv-467 (CHEBI:759878) is a organonitrogen heterocyclic compound (CHEBI:38101)
abbv-467 (CHEBI:759878) is a organosulfur heterocyclic compound (CHEBI:38106)
Synonym  Source
Abbv-467ChEMBL