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CHEBI:201999 - 3,5-dichloro-2'-O-methylnorhyperlatolic acid

Default Structure
ChEBI IDCHEBI:201999
ChEBI Name3,5-dichloro-2'-O-methylnorhyperlatolic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H34Cl2O7
Net Charge0
Average Mass541.468
Monoisotopic Mass540.16816
SMILESCCCCCCCc1cc(OC(=O)c2c(O)c(Cl)c(O)c(Cl)c2CCCCC)cc(OC)c1C(=O)O
InChIInChI=1S/C27H34Cl2O7/c1-4-6-8-9-11-12-16-14-17(15-19(35-3)20(16)26(32)33)36-27(34)21-18(13-10-7-5-2)22(28)25(31)23(29)24(21)30/h14-15,30-31H,4-13H2,1-3H3,(H,32,33)
InChIKeyBPQUEBHOIAJDQO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Lecanora lividocinerea (ncbitaxon:742147) - DOI (10.1071/c97052)
ChEBI Ontology
Outgoing Relation(s)
3,5-dichloro-2'-O-methylnorhyperlatolic acid (CHEBI:201999) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
4-(3,5-dichloro-2,4-dihydroxy-6-pentylbenzoyl)oxy-2-heptyl-6-methoxybenzoic acid
Manual XrefsDatabases
78435434ChemSpider