EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:3569 - Chaksine

ChEBI IDCHEBI:3569
ChEBI NameChaksine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H38N6O4
Net Charge0
Average Mass450.584
Monoisotopic Mass450.29545
SMILES[H][C@]1([C@]2([H])CNC(N)=N2)CCC[C@@H](C)COC(=O)[C@@]([H])([C@]2([H])CNC(N)=N2)CCC[C@@H](C)COC1=O
InChIInChI=1S/C22H38N6O4/c1-13-5-3-7-15(17-9-25-21(23)27-17)20(30)32-12-14(2)6-4-8-16(19(29)31-11-13)18-10-26-22(24)28-18/h13-18H,3-12H2,1-2H3,(H3,23,25,27)(H3,24,26,28)/t13-,14-,15-,16-,17+,18+/m1/s1
InChIKeyCGGAHJGHSHWGLE-WJQMWINMSA-N
ChEBI Ontology
Outgoing Relation(s)
Chaksine (CHEBI:3569) is a macrolide (CHEBI:25106)
Synonym  Source
ChaksineKEGG COMPOUND
Manual XrefsDatabases
C09940KEGG COMPOUND
C00001969KNApSAcK
Registry NumbersSources
CAS:486-53-3KEGG COMPOUND