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CHEBI:175669 - N-Desmethylrosuvastatin

ChEBI IDCHEBI:175669
ChEBI NameN-Desmethylrosuvastatin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H26FN3O6S
Net Charge0
Average Mass467.519
Monoisotopic Mass467.15263
SMILESCC(C)c1nc(NS(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)O
InChIInChI=1S/C21H26FN3O6S/c1-12(2)19-17(9-8-15(26)10-16(27)11-18(28)29)20(13-4-6-14(22)7-5-13)24-21(23-19)25-32(3,30)31/h4-9,12,15-16,26-27H,10-11H2,1-3H3,(H,28,29)(H,23,24,25)/b9-8+/t15-,16-/m1/s1
InChIKeyDJUKMHIJCDJSIJ-GUFYHEMZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-Desmethylrosuvastatin (CHEBI:175669) is a pyrimidines (CHEBI:39447)
IUPAC Name 
(E,3R,5S)-7-[4-(4-luorophenyl)-2-(methanesulonamido)-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid
Manual XrefsDatabases
HMDB0060942HMDB
8131833ChemSpider
Registry NumbersSources
CAS:371775-74-5ChemIDplus