CHEBI:100341 - (2R,3R,3aS,9bS)-1-[(2-fluorophenyl)-oxomethyl]-3-(hydroxymethyl)-6-oxo-N-propyl-7-(3-pyridinyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2R,3R,3aS,9bS)-1-[(2-fluorophenyl)-oxomethyl]-3-(hydroxymethyl)-6-oxo-N-propyl-7-(3-pyridinyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
ChEBI ID CHEBI:100341
Stars This entity has been manually annotated by a third party.
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Formula C27H27FN4O4
Net Charge 0
Average Mass 490.527
Monoisotopic Mass 490.20163
InChI InChI=1S/C27H27FN4O4/c1-2-11-30-25(34)24-20(15-33)19-14-31-22(10-9-17(26(31)35)16-6-5-12-29-13-16)23(19)32(24)27(36)18-7-3-4-8-21(18)28/h3-10,12-13,19-20,23-24,33H,2,11,14-15H2,1H3,(H,30,34)/t19-,20-,23+,24-/m1/s1
InChIKey LVLNEDZJLRSBBP-MYSJAJEPSA-N
SMILES CCCNC(=O)[C@H]1[C@@H]([C@H]2CN3C(=CC=C(C3=O)C4=CN=CC=C4)[C@H]2N1C(=O)C5=CC=CC=C5F)CO
ChEBI Ontology
Outgoing (2R,3R,3aS,9bS)-1-[(2-fluorophenyl)-oxomethyl]-3-(hydroxymethyl)-6-oxo-N-propyl-7-(3-pyridinyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:100341) is a bipyridines (CHEBI:50511)
Manual Xref Database
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