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CHEBI:191511 - Chrysophanol 8-(6-galloylglucoside)

ChEBI IDCHEBI:191511
ChEBI NameChrysophanol 8-(6-galloylglucoside)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H24O13
Net Charge0
Average Mass568.487
Monoisotopic Mass568.12169
SMILESCc1cc(O)c2c(c1)C(=O)c1cccc(OC3OC(COC(=O)c4cc(O)c(O)c(O)c4)C(O)C(O)C3O)c1C2=O
InChIInChI=1S/C28H24O13/c1-10-5-13-19(14(29)6-10)24(35)20-12(21(13)32)3-2-4-17(20)40-28-26(37)25(36)23(34)18(41-28)9-39-27(38)11-7-15(30)22(33)16(31)8-11/h2-8,18,23,25-26,28-31,33-34,36-37H,9H2,1H3
InChIKeyKBGOIDOUXFNKHS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Chrysophanol 8-(6-galloylglucoside) (CHEBI:191511) is a anthraquinone (CHEBI:22580)
IUPAC Name 
[3,4,5-trihydroxy-6-(8-hydroxy-6-methyl-9,10-dioxoanthracen-1-yl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Manual XrefsDatabases
HMDB0037087HMDB