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CHEBI:223905 - Nostotrebinlactone 7

ChEBI IDCHEBI:223905
ChEBI NameNostotrebinlactone 7
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SubmitterMetaboLights
DownloadsMolfile
FormulaC50H38O11
Net Charge0
Average Mass814.843
Monoisotopic Mass814.24141
SMILESO=C1C(Cc2ccc(O)cc2)=C(Cc2ccc(O)cc2)C(=O)C1(c1ccc(O)cc1)c1cc(Cc2c(Cc3ccc(O)cc3)cc(-c3ccc(O)cc3)oc2=O)c(O)cc1O
InChIInChI=1S/C50H38O11/c51-35-11-1-28(2-12-35)21-32-26-46(31-7-17-38(54)18-8-31)61-49(60)40(32)24-33-25-43(45(57)27-44(33)56)50(34-9-19-39(55)20-10-34)47(58)41(22-29-3-13-36(52)14-4-29)42(48(50)59)23-30-5-15-37(53)16-6-30/h1-20,25-27,51-57H,21-24H2
InChIKeyAUBZSMDAMFIBDR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nostoc (ncbitaxon:1177) - PubMed (31977209)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Nostotrebinlactone 7 (CHEBI:223905) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
2-[2,4-dihydroxy-5-[[6-(4-hydroxyphenyl)-4-[(4-hydroxyphenyl)methyl]-2-oxopyran-3-yl]methyl]phenyl]-2-(4-hydroxyphenyl)-4,5-bis[(4-hydroxyphenyl)methyl]cyclopent-4-ene-1,3-dione
Manual XrefsDatabases
128727958ChemSpider