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CHEBI:207006 - Pseudonocardone B

ChEBI IDCHEBI:207006
ChEBI NamePseudonocardone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H22O10
Net Charge0
Average Mass494.452
Monoisotopic Mass494.12130
SMILESCOc1cccc2c1C(=O)c1ccc3cc(C)cc(O[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]4O)c3c1C2=O
InChIInChI=1S/C26H22O10/c1-10-8-11-6-7-13-18(20(28)12-4-3-5-14(34-2)17(12)19(13)27)16(11)15(9-10)35-26-23(31)21(29)22(30)24(36-26)25(32)33/h3-9,21-24,26,29-31H,1-2H3,(H,32,33)/t21-,22-,23+,24-,26+/m0/s1
InChIKeyAMWRMWBDZWNIIN-TYUWDEHNSA-N
Species of MetaboliteComponentSourceComments
Pseudonocardiaspecies (ncbitaxon:60912) - PubMed (23025282)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
Pseudonocardone B (CHEBI:207006) is a angucycline (CHEBI:48130)
IUPAC Name 
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(8-methoxy-3-methyl-7,12-dioxobenzo[a]anthracen-1-yl)oxyoxane-2-carboxylic acid
Manual XrefsDatabases
28670253ChemSpider