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CHEBI:198437 - 6-methoxy-3,6a,7,10-tetrahydroxy-4,9-dioxo-4,5,6,6a,6b,7,8,9-octahydroperylene

ChEBI IDCHEBI:198437
ChEBI Name6-methoxy-3,6a,7,10-tetrahydroxy-4,9-dioxo-4,5,6,6a,6b,7,8,9-octahydroperylene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H18O7
Net Charge0
Average Mass382.368
Monoisotopic Mass382.10525
SMILESCO[C@@H]1CC(=O)c2c(O)ccc3c2[C@]1(O)[C@H]1c2c-3ccc(O)c2C(=O)C[C@@H]1O
InChIInChI=1S/C21H18O7/c1-28-15-7-13(25)18-11(23)5-3-9-8-2-4-10(22)17-12(24)6-14(26)20(16(8)17)21(15,27)19(9)18/h2-5,14-15,20,22-23,26-27H,6-7H2,1H3/t14-,15+,20+,21-/m0/s1
InChIKeyYPAHBOZUSRZWSW-RSMHBEIYSA-N
Species of MetaboliteComponentSourceComments
Alternariaspecies (ncbitaxon:1715220) - DOI (10.1016/j.phytol.2015.01.008)
ChEBI Ontology
Outgoing Relation(s)
6-methoxy-3,6a,7,10-tetrahydroxy-4,9-dioxo-4,5,6,6a,6b,7,8,9-octahydroperylene (CHEBI:198437) is a naphthalenone (CHEBI:25479)
IUPAC Name 
(1R,12S,12aS,12bR)-4,9,12,12b-tetrahydroxy-1-methoxy-2,11,12,12a-tetrahydro-1H-perylene-3,10-dione
Manual XrefsDatabases
78442234ChemSpider