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CHEBI:123226 - (3R)-7-phenyl-2-(phenylmethyl)-3-[4-(trifluoromethyl)phenyl]-3a,6,7,7a-tetrahydro-3H-isoindol-1-one

ChEBI IDCHEBI:123226
ChEBI Name(3R)-7-phenyl-2-(phenylmethyl)-3-[4-(trifluoromethyl)phenyl]-3a,6,7,7a-tetrahydro-3H-isoindol-1-one
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FormulaC28H24F3NO
Net Charge0
Average Mass447.500
Monoisotopic Mass447.18100
SMILESO=C1C2C(c3ccccc3)CC=CC2[C@H](c2ccc(C(F)(F)F)cc2)N1Cc1ccccc1
InChIInChI=1S/C28H24F3NO/c29-28(30,31)22-16-14-21(15-17-22)26-24-13-7-12-23(20-10-5-2-6-11-20)25(24)27(33)32(26)18-19-8-3-1-4-9-19/h1-11,13-17,23-26H,12,18H2/t23?,24?,25?,26-/m0/s1
InChIKeyWYYXBFAZCDHMPY-ILVMPNSOSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-7-phenyl-2-(phenylmethyl)-3-[4-(trifluoromethyl)phenyl]-3a,6,7,7a-tetrahydro-3H-isoindol-1-one (CHEBI:123226) is a pyrrolidines (CHEBI:38260)
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LSM-34668LINCS