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CHEBI:204752 - Bicytosporone D

ChEBI IDCHEBI:204752
ChEBI NameBicytosporone D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H42O10
Net Charge0
Average Mass586.678
Monoisotopic Mass586.27780
SMILESCCCCCCCC1OC(=O)C(C2C(=O)OC(CCCCCCC)c3c2cc(O)c(O)c3O)c2cc(O)c(O)c(O)c21
InChIInChI=1S/C32H42O10/c1-3-5-7-9-11-13-21-23-17(15-19(33)27(35)29(23)37)25(31(39)41-21)26-18-16-20(34)28(36)30(38)24(18)22(42-32(26)40)14-12-10-8-6-4-2/h15-16,21-22,25-26,33-38H,3-14H2,1-2H3
InChIKeyGBNMHTUXVBAOCO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sarocladium strictum (ncbitaxon:5046) - DOI (10.1016/j.tetlet.2014.04.063)
ChEBI Ontology
Outgoing Relation(s)
Bicytosporone D (CHEBI:204752) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
1-heptyl-4-(1-heptyl-6,7,8-trihydroxy-3-oxo-1,4-dihydroisochromen-4-yl)-6,7,8-trihydroxy-1,4-dihydroisochromen-3-one
Manual XrefsDatabases
32675118ChemSpider