EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:199085 - Carnemycin B

ChEBI IDCHEBI:199085
ChEBI NameCarnemycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32O9
Net Charge0
Average Mass452.500
Monoisotopic Mass452.20463
SMILESCCCC=CC=CCCc1cc(O)c(C2OC(CO)C(O)C(O)C2O)c(O)c1C(=O)OC
InChIInChI=1S/C23H32O9/c1-3-4-5-6-7-8-9-10-13-11-14(25)17(19(27)16(13)23(30)31-2)22-21(29)20(28)18(26)15(12-24)32-22/h5-8,11,15,18,20-22,24-29H,3-4,9-10,12H2,1-2H3
InChIKeyGNMYZMZOACOUID-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (22658281)
ChEBI Ontology
Outgoing Relation(s)
Carnemycin B (CHEBI:199085) is a glycoside (CHEBI:24400)
IUPAC Name 
methyl 2,4-dihydroxy-6-nona-3,5-dienyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]benzoate