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CHEBI:182465 - Lincomycin hydrochloride

ChEBI IDCHEBI:182465
ChEBI NameLincomycin hydrochloride
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H34N2O6S.HCl
Net Charge0
Average Mass443.006
Monoisotopic Mass442.19044
SMILESCl.[H][C@@]1([C@H](NC(=O)[C@@H]2C[C@@H](CCC)CN2C)[C@@H](C)O)O[C@H](SC)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C18H34N2O6S.ClH/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4;/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25);1H/t9-,10-,11+,12-,13+,14+,15-,16+,18-;/m1./s1
InChIKeyPOUMFISTNHIPTI-BOTOIELMSA-N
ChEBI Ontology
Outgoing Relation(s)
Lincomycin hydrochloride (CHEBI:182465) is a proline derivative (CHEBI:26273)
IUPAC Name 
(2S,4R)-N-[(1R,2R)-2-hydroxy-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide;hydrochloride
Manual XrefsDatabases
58258ChemSpider
Registry NumbersSources
CAS:859-18-7ChemIDplus