EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:217085 - Sacchathridine A

ChEBI IDCHEBI:217085
ChEBI NameSacchathridine A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24N2O9
Net Charge0
Average Mass436.417
Monoisotopic Mass436.14818
SMILESCOc1c(C)c(O)c2ccc(O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)c(N=NC(C)=O)c2c1O
InChIInChI=1S/C20H24N2O9/c1-7-14(24)10-5-6-11(31-20-18(28)17(27)15(25)8(2)30-20)13(22-21-9(3)23)12(10)16(26)19(7)29-4/h5-6,8,15,17-18,20,24-28H,1-4H3/t8-,15-,17+,18+,20-/m0/s1
InChIKeyVVWYWGPBHPCXQS-XZEUZNNKSA-N
Species of MetaboliteComponentSourceComments
Saccharothrixspecies MI559-46F5 (ncbitaxon:1301612) - PubMed (23581596)
ChEBI Ontology
Outgoing Relation(s)
Sacchathridine A (CHEBI:217085) is a glycoside (CHEBI:24400)
IUPAC Name 
N-[5,8-dihydroxy-7-methoxy-6-methyl-2-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxynaphthalen-1-yl]iminoacetamide
Manual XrefsDatabases
78438132ChemSpider