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CHEBI:98544 - (2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-1-(1,3-oxazol-4-ylmethyl)-6-oxo-N-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

ChEBI IDCHEBI:98544
ChEBI Name(2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-1-(1,3-oxazol-4-ylmethyl)-6-oxo-N-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
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DownloadsMolfile
FormulaC28H30N4O4
Net Charge0
Average Mass486.572
Monoisotopic Mass486.22671
SMILESO=C(Nc1ccccc1)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N1Cc1cocn1
InChIInChI=1S/C28H30N4O4/c33-15-23-22-14-31-24(12-11-21(28(31)35)18-7-3-1-4-8-18)25(22)32(13-20-16-36-17-29-20)26(23)27(34)30-19-9-5-2-6-10-19/h2,5-7,9-12,16-17,22-23,25-26,33H,1,3-4,8,13-15H2,(H,30,34)/t22-,23-,25+,26-/m1/s1
InChIKeyNLGBQKPPTNRTKJ-VHCQPULKSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-1-(1,3-oxazol-4-ylmethyl)-6-oxo-N-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:98544) is a amino acid amide (CHEBI:22475)
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