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CHEBI:210097 - Fredericamycin C2

ChEBI IDCHEBI:210097
ChEBI NameFredericamycin C2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H20O11
Net Charge0
Average Mass520.446
Monoisotopic Mass520.10056
SMILESCOc1cc(O)c2c(c1O)C(=O)c1c(O)c3c(c(O)c1C2=O)CCc1cc(CC(C)=O)c(C(=O)O)c(O)c1-3
InChIInChI=1S/C27H20O11/c1-8(28)5-10-6-9-3-4-11-16(14(9)23(32)15(10)27(36)37)24(33)20-19(21(11)30)25(34)17-12(29)7-13(38-2)22(31)18(17)26(20)35/h6-7,29-33H,3-5H2,1-2H3,(H,36,37)
InChIKeyUGHQOOSSORTPDY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32481766)
ChEBI Ontology
Outgoing Relation(s)
Fredericamycin C2 (CHEBI:210097) is a quinone (CHEBI:36141)
Fredericamycin C2 (CHEBI:210097) is a tetracenes (CHEBI:51270)
IUPAC Name 
1,7,9,12,14-pentahydroxy-11-methoxy-8,13-dioxo-3-(2-oxopropyl)-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid