CHEBI:101530 - (2R,3R,3aS,9bS)-N-(cyclohexylmethyl)-7-(2-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide

ChEBI IDCHEBI:101530
ChEBI Name(2R,3R,3aS,9bS)-N-(cyclohexylmethyl)-7-(2-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide
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FormulaC25H30FN3O3
Net Charge0
Average Mass439.531
Monoisotopic Mass439.22712
SMILESO=C(NCC1CCCCC1)[C@@H]1N[C@@H]2c3ccc(-c4ccccc4F)c(=O)n3C[C@@H]2[C@H]1CO
InChIInChI=1S/C25H30FN3O3/c26-20-9-5-4-8-16(20)17-10-11-21-22-18(13-29(21)25(17)32)19(14-30)23(28-22)24(31)27-12-15-6-2-1-3-7-15/h4-5,8-11,15,18-19,22-23,28,30H,1-3,6-7,12-14H2,(H,27,31)/t18-,19-,22+,23-/m1/s1
InChIKeyIZVHJOOQVCWXPA-PJIZGREPSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-N-(cyclohexylmethyl)-7-(2-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:101530) is a phenylpyridine (CHEBI:38193)
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