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CHEBI:201416 - Clindamycin hydrochloride monohydrate

ChEBI IDCHEBI:201416
ChEBI NameClindamycin hydrochloride monohydrate
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FormulaC18H33ClN2O5S.HCl
Net Charge0
Average Mass461.452
Monoisotopic Mass460.15655
SMILESCCCC1CC(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)N(C)C1.Cl
InChIInChI=1S/C18H33ClN2O5S.ClH/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4;/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25);1H
InChIKeyAUODDLQVRAJAJM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Clindamycin hydrochloride monohydrate (CHEBI:201416) is a S-glycosyl compound (CHEBI:35275)
IUPAC Name 
(2S,4R)-N-[2-chloro-1-[(3R,4S)-3,4,5-trihydroxy-6-methylsulanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide;hydrochloride
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