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CHEBI:199387 - 6,12-dihydroxy-8-methoxy-3-methyl-1-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-12H-benzo[a]anthracen-7-one

ChEBI IDCHEBI:199387
ChEBI Name6,12-dihydroxy-8-methoxy-3-methyl-1-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-12H-benzo[a]anthracen-7-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H26O9
Net Charge0
Average Mass482.485
Monoisotopic Mass482.15768
SMILESCOc1cccc2c1C(=O)c1c(O)cc3cc(C)cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c3c1C2O
InChIInChI=1S/C26H26O9/c1-10-7-12-9-14(27)19-20(22(29)13-5-4-6-15(33-3)18(13)23(19)30)17(12)16(8-10)35-26-25(32)24(31)21(28)11(2)34-26/h4-9,11,21-22,24-29,31-32H,1-3H3/t11-,21-,22?,24+,25+,26-/m0/s1
InChIKeyRZMPVILSPGQMIZ-YYTCSLPCSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies CB01913 (ncbitaxon:1712655) - PubMed (26335269)
ChEBI Ontology
Outgoing Relation(s)
6,12-dihydroxy-8-methoxy-3-methyl-1-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-12H-benzo[a]anthracen-7-one (CHEBI:199387) is a glycoside (CHEBI:24400)
IUPAC Name 
6,12-dihydroxy-8-methoxy-3-methyl-1-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-12H-benzo[a]anthracen-7-one
Manual XrefsDatabases
78436497ChemSpider