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CHEBI:224430 - 11-O-demethyl-6-deoxypradinone I

ChEBI IDCHEBI:224430
ChEBI Name11-O-demethyl-6-deoxypradinone I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H16O9
Net Charge0
Average Mass448.383
Monoisotopic Mass448.07943
SMILESCc1cc2c(c(O)c1C(=O)O)-c1c(cc3c(c1O)C(=O)c1cc(O)cc(O)c1C3=O)C[C@H]2O
InChIInChI=1S/C24H16O9/c1-7-2-10-13(26)4-8-3-11-19(23(31)16(8)18(10)22(30)15(7)24(32)33)21(29)12-5-9(25)6-14(27)17(12)20(11)28/h2-3,5-6,13,25-27,30-31H,4H2,1H3,(H,32,33)/t13-/m1/s1
InChIKeySZJZDCLDKZECMR-CYBMUJFWSA-N
Species of MetaboliteComponentSourceComments
Actinomadura (ncbitaxon:1988) - PubMed (8478259)
ChEBI Ontology
Outgoing Relation(s)
11-O-demethyl-6-deoxypradinone I (CHEBI:224430) is a quinone (CHEBI:36141)
11-O-demethyl-6-deoxypradinone I (CHEBI:224430) is a tetracenes (CHEBI:51270)
IUPAC Name 
(5R)-1,5,9,11,14-pentahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
Manual XrefsDatabases
8202228ChemSpider