CHEBI:223765 - Agaricoglyceride B

ChEBI IDCHEBI:223765
ChEBI NameAgaricoglyceride B
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SubmitterMetaboLights
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FormulaC24H15Cl5O9
Net Charge0
Average Mass624.640
Monoisotopic Mass621.91587
SMILESO=C(OCC(COC(=O)c1cc(Cl)c(O)c(Cl)c1)OC(=O)c1ccc(O)c(Cl)c1)c1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C24H15Cl5O9/c25-14-3-10(1-2-19(14)30)24(35)38-13(8-36-22(33)11-4-15(26)20(31)16(27)5-11)9-37-23(34)12-6-17(28)21(32)18(29)7-12/h1-7,13,30-32H,8-9H2
InChIKeyCNPGDWSSEQJRIH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Agaricus macrosporus (ncbitaxon:182817) - PubMed (16506695)
ChEBI Ontology
Outgoing Relation(s)
Agaricoglyceride B (CHEBI:223765) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
[2-(3-chloro-4-hydroxybenzoyl)oxy-3-(3,5-dichloro-4-hydroxybenzoyl)oxypropyl] 3,5-dichloro-4-hydroxybenzoate
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