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CHEBI:125973 - 2-cyclopropyl-1-[(3R)-3-(2-hydroxyethyl)-6-[(4-methyl-1-piperazinyl)-oxomethyl]-4-[3-(3-pyridinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-2-yl]ethanone

ChEBI IDCHEBI:125973
ChEBI Name2-cyclopropyl-1-[(3R)-3-(2-hydroxyethyl)-6-[(4-methyl-1-piperazinyl)-oxomethyl]-4-[3-(3-pyridinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-2-yl]ethanone
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DownloadsMolfile
FormulaC31H35N5O3
Net Charge0
Average Mass525.653
Monoisotopic Mass525.27399
SMILESCN1CCN(C(=O)c2cc3c(c(-c4cccc(-c5cccnc5)c4)n2)[C@@H](CCO)N(C(=O)CC2CC2)C3)CC1
InChIInChI=1S/C31H35N5O3/c1-34-11-13-35(14-12-34)31(39)26-18-25-20-36(28(38)16-21-7-8-21)27(9-15-37)29(25)30(33-26)23-5-2-4-22(17-23)24-6-3-10-32-19-24/h2-6,10,17-19,21,27,37H,7-9,11-16,20H2,1H3/t27-/m1/s1
InChIKeyQQJSYFVCSFLXNW-HHHXNRCGSA-N
ChEBI Ontology
Outgoing Relation(s)
2-cyclopropyl-1-[(3R)-3-(2-hydroxyethyl)-6-[(4-methyl-1-piperazinyl)-oxomethyl]-4-[3-(3-pyridinyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-2-yl]ethanone (CHEBI:125973) is a phenylpyridine (CHEBI:38193)
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