EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:31125 - 4-Demethylpremithramycinone

ChEBI IDCHEBI:31125
ChEBI Name4-Demethylpremithramycinone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H16O9
Net Charge0
Average Mass400.339
Monoisotopic Mass400.07943
SMILES[H][C@@]12Cc3cc4cc(O)cc(O)c4c(O)c3C(=O)[C@]1(O)C(=O)C(C(C)=O)=C(O)[C@H]2O
InChIInChI=1S/C20H16O9/c1-6(21)12-17(26)15(24)10-4-8-2-7-3-9(22)5-11(23)13(7)16(25)14(8)19(28)20(10,29)18(12)27/h2-3,5,10,15,22-26,29H,4H2,1H3/t10-,15-,20+/m0/s1
InChIKeyPVBMPOWPNVAEKO-KAFSRPFYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-Demethylpremithramycinone (CHEBI:31125) is a naphthols (CHEBI:25392)
Synonym  Source
4-DemethylpremithramycinoneKEGG COMPOUND
Manual XrefsDatabases
C12382KEGG COMPOUND