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CHEBI:98019 - (2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-N,N-dimethyl-6-oxo-1-(pyridin-2-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

ChEBI IDCHEBI:98019
ChEBI Name(2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-N,N-dimethyl-6-oxo-1-(pyridin-2-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
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DownloadsMolfile
FormulaC26H32N4O3
Net Charge0
Average Mass448.567
Monoisotopic Mass448.24744
SMILESCN(C)C(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]2N1Cc1ccccn1
InChIInChI=1S/C26H32N4O3/c1-28(2)26(33)24-21(16-31)20-15-29-22(23(20)30(24)14-18-10-6-7-13-27-18)12-11-19(25(29)32)17-8-4-3-5-9-17/h6-8,10-13,20-21,23-24,31H,3-5,9,14-16H2,1-2H3/t20-,21-,23+,24-/m1/s1
InChIKeyQLERNNCBDUJEFV-CJTFWIGWSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,3aS,9bS)-7-(cyclohexen-1-yl)-3-(hydroxymethyl)-N,N-dimethyl-6-oxo-1-(pyridin-2-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:98019) is a amino acid amide (CHEBI:22475)
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