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CHEBI:79995 - GW 3965

ChEBI IDCHEBI:79995
ChEBI NameGW 3965
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC33H31ClF3NO3
Net Charge0
Average Mass582.062
Monoisotopic Mass581.19446
SMILESO=C(O)Cc1cccc(OCCCN(Cc2cccc(C(F)(F)F)c2Cl)CC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C33H31ClF3NO3/c34-32-27(15-8-17-30(32)33(35,36)37)22-38(18-9-19-41-28-16-7-10-24(20-28)21-31(39)40)23-29(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-8,10-17,20,29H,9,18-19,21-23H2,(H,39,40)
InChIKeyNAXSRXHZFIBFMI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
GW 3965 (CHEBI:79995) is a diarylmethane (CHEBI:51614)
Manual XrefsDatabases
C15631KEGG COMPOUND
LSM-2738LINCS
Registry NumbersSources
CAS:405911-09-3KEGG COMPOUND