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CHEBI:98990 - (2S,3S,3aR,9bR)-3-(hydroxymethyl)-7-(2-methoxyphenyl)-6-oxo-1-propyl-N-(2-thiazolyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

ChEBI IDCHEBI:98990
ChEBI Name(2S,3S,3aR,9bR)-3-(hydroxymethyl)-7-(2-methoxyphenyl)-6-oxo-1-propyl-N-(2-thiazolyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
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DownloadsMolfile
FormulaC25H28N4O4S
Net Charge0
Average Mass480.590
Monoisotopic Mass480.18313
SMILESCCCN1[C@H](C(=O)Nc2nccs2)[C@@H](CO)[C@@H]2Cn3c(ccc(-c4ccccc4OC)c3=O)[C@@H]21
InChIInChI=1S/C25H28N4O4S/c1-3-11-28-21-17(18(14-30)22(28)23(31)27-25-26-10-12-34-25)13-29-19(21)9-8-16(24(29)32)15-6-4-5-7-20(15)33-2/h4-10,12,17-18,21-22,30H,3,11,13-14H2,1-2H3,(H,26,27,31)/t17-,18-,21+,22-/m0/s1
InChIKeyFBORFXHKEDCJEC-HXHBTQRASA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S,3aR,9bR)-3-(hydroxymethyl)-7-(2-methoxyphenyl)-6-oxo-1-propyl-N-(2-thiazolyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:98990) is a phenylpyridine (CHEBI:38193)
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