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CHEBI:217726 - Anhydroflavomannin-9,10-quinone 6,6',8'-tri-O-methyl ether

ChEBI IDCHEBI:217726
ChEBI NameAnhydroflavomannin-9,10-quinone 6,6',8'-tri-O-methyl ether
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H28O10
Net Charge0
Average Mass584.577
Monoisotopic Mass584.16825
SMILESCOc1cc2c(c(O)c1-c1c(OC)cc3cc4c(c(O)c3c1OC)C(=O)C[C@@](C)(O)C4)C(=O)c1c(O)cc(C)cc1C2=O
InChIInChI=1S/C33H28O10/c1-13-6-16-24(18(34)7-13)30(38)25-17(28(16)36)10-21(42-4)26(31(25)39)27-20(41-3)9-14-8-15-11-33(2,40)12-19(35)22(15)29(37)23(14)32(27)43-5/h6-10,34,37,39-40H,11-12H2,1-5H3/t33-/m0/s1
InChIKeyMRAFWYNEGCCPNO-XIFFEERXSA-N
Species of MetaboliteComponentSourceComments
Dermocybe (ncbitaxon:47341) - DOI (10.1071/ch99115)
ChEBI Ontology
Outgoing Relation(s)
Anhydroflavomannin-9,10-quinone 6,6',8'-tri-O-methyl ether (CHEBI:217726) is a anthraquinone (CHEBI:22580)
IUPAC Name 
2-[(6S)-6,9-dihydroxy-1,3-dimethoxy-6-methyl-8-oxo-5,7-dihydroanthracen-2-yl]-1,8-dihydroxy-3-methoxy-6-methylanthracene-9,10-dione
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78437586ChemSpider