CHEBI:101108 - (2R,3R,3aS,9bS)-3-(hydroxymethyl)-1-(4-oxazolylmethyl)-2-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizin-6-one

ChEBI IDCHEBI:101108
ChEBI Name(2R,3R,3aS,9bS)-3-(hydroxymethyl)-1-(4-oxazolylmethyl)-2-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizin-6-one
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DownloadsMolfile
FormulaC28H32N4O4
Net Charge0
Average Mass488.588
Monoisotopic Mass488.24236
SMILESO=C([C@H]1[C@H](CO)[C@H]2Cn3c(cccc3=O)[C@H]2N1Cc1cocn1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C28H32N4O4/c33-16-23-22-15-31-24(7-4-8-25(31)34)26(22)32(14-21-17-36-18-29-21)27(23)28(35)30-11-9-20(10-12-30)13-19-5-2-1-3-6-19/h1-8,17-18,20,22-23,26-27,33H,9-16H2/t22-,23-,26+,27-/m1/s1
InChIKeyYCNDEIYRXZASMY-JUIYCPNDSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-3-(hydroxymethyl)-1-(4-oxazolylmethyl)-2-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizin-6-one (CHEBI:101108) is a piperidines (CHEBI:26151)
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LSM-12477LINCS