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CHEBI:131044 - (3R)-3-(2-hydroxyethyl)-4-[3-(2-methoxyphenyl)phenyl]-2-(1-oxopropyl)-N-(2-thiazolyl)-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide

ChEBI IDCHEBI:131044
ChEBI Name(3R)-3-(2-hydroxyethyl)-4-[3-(2-methoxyphenyl)phenyl]-2-(1-oxopropyl)-N-(2-thiazolyl)-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide
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FormulaC29H28N4O4S
Net Charge0
Average Mass528.634
Monoisotopic Mass528.18313
SMILESCCC(=O)N1Cc2cc(C(=O)Nc3nccs3)nc(-c3cccc(-c4ccccc4OC)c3)c2[C@H]1CCO
InChIInChI=1S/C29H28N4O4S/c1-3-25(35)33-17-20-16-22(28(36)32-29-30-12-14-38-29)31-27(26(20)23(33)11-13-34)19-8-6-7-18(15-19)21-9-4-5-10-24(21)37-2/h4-10,12,14-16,23,34H,3,11,13,17H2,1-2H3,(H,30,32,36)/t23-/m1/s1
InChIKeyFMPTZOOOLDOBNB-HSZRJFAPSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-3-(2-hydroxyethyl)-4-[3-(2-methoxyphenyl)phenyl]-2-(1-oxopropyl)-N-(2-thiazolyl)-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide (CHEBI:131044) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-42592LINCS