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CHEBI:177801 - Laninamivir

ChEBI IDCHEBI:177801
ChEBI NameLaninamivir
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22N4O7
Net Charge0
Average Mass346.340
Monoisotopic Mass346.14885
SMILES[H][C@@]1([C@H](OC)[C@H](O)CO)OC(C(=O)O)=C[C@H](N=C(N)N)[C@H]1NC(C)=O
InChIInChI=1S/C13H22N4O7/c1-5(19)16-9-6(17-13(14)15)3-8(12(21)22)24-11(9)10(23-2)7(20)4-18/h3,6-7,9-11,18,20H,4H2,1-2H3,(H,16,19)(H,21,22)(H4,14,15,17)/t6-,7+,9+,10+,11+/m0/s1
InChIKeyQNRRHYPPQFELSF-CNYIRLTGSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Laninamivir (CHEBI:177801) is a acetamides (CHEBI:22160)
IUPAC Name 
(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-2,3-dihydroxy-1-methoxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
Manual XrefsDatabases
D09410KEGG DRUG
439182ChemSpider
DB12791DrugBank
C21557KEGG COMPOUND
LNVPDBeChem
Registry NumbersSources
CAS:203120-17-6ChemIDplus