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CHEBI:224435 - Pradinone I

ChEBI IDCHEBI:224435
ChEBI NamePradinone I
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SubmitterMetaboLights
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FormulaC25H18O10
Net Charge0
Average Mass478.409
Monoisotopic Mass478.09000
SMILESCOc1cc(O)c2c(c1)C(=O)c1c(cc3c(c1O)-c1c(cc(C)c(C(=O)O)c1O)[C@H](O)[C@H]3O)C2=O
InChIInChI=1S/C25H18O10/c1-7-3-9-16(23(31)14(7)25(33)34)17-11(22(30)21(9)29)6-12-18(24(17)32)20(28)10-4-8(35-2)5-13(26)15(10)19(12)27/h3-6,21-22,26,29-32H,1-2H3,(H,33,34)/t21-,22-/m0/s1
InChIKeyYKVHLDYSTLOBDC-VXKWHMMOSA-N
Species of MetaboliteComponentSourceComments
Actinomadura (ncbitaxon:1988) - PubMed (8478259)
ChEBI Ontology
Outgoing Relation(s)
Pradinone I (CHEBI:224435) is a quinone (CHEBI:36141)
Pradinone I (CHEBI:224435) is a tetracenes (CHEBI:51270)
IUPAC Name 
(5S,6S)-1,5,6,9,14-pentahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
Manual XrefsDatabases
405478ChemSpider