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CHEBI:192051 - Mulberrofuran M

ChEBI IDCHEBI:192051
ChEBI NameMulberrofuran M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H22O10
Net Charge0
Average Mass590.540
Monoisotopic Mass590.12130
SMILESCC12CC(c3ccc(O)cc3O1)c1oc3cc(-c4cc5ccc(O)cc5o4)cc(OC(=O)c4ccc(O)cc4O)c3c1C2=O
InChIInChI=1S/C34H22O10/c1-34-14-22(20-6-4-19(37)13-26(20)44-34)31-30(32(34)39)29-27(42-31)9-16(24-8-15-2-3-18(36)12-25(15)41-24)10-28(29)43-33(40)21-7-5-17(35)11-23(21)38/h2-13,22,35-38H,14H2,1H3
InChIKeyUCGIUWUATGREEP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Populus trichocarpa (ncbitaxon:3694) root (BTO:0001188) MetaboLights (MTBLS4196)
ChEBI Ontology
Outgoing Relation(s)
Mulberrofuran M (CHEBI:192051) is a benzofurans (CHEBI:35259)
IUPAC Name 
[16-hydroxy-6-(6-hydroxy-1-benzouran-2-yl)-12-methyl-11-oxo-3,13-dioxapentacyclo[10.7.1.02,10.04,9.014,19]icosa-2(10),4(9),5,7,14(19),15,17-heptaen-8-yl] 2,4-dihydroxybenzoate
Manual XrefsDatabases
10218753ChemSpider
HMDB0033261HMDB