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CHEBI:211865 - Aurantricholone

ChEBI IDCHEBI:211865
ChEBI NameAurantricholone
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SubmitterMetaboLights
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FormulaC33H20O10
Net Charge0
Average Mass576.513
Monoisotopic Mass576.10565
SMILESO=C1O/C(=C\c2cc(O)c(=O)c3c(O)c(O)cc(/C=C4\OC(=O)C(c5ccccc5)=C4O)c3c2)C(O)=C1c1ccccc1
InChIInChI=1S/C33H20O10/c34-21-12-16(13-23-30(38)25(32(40)42-23)17-7-3-1-4-8-17)11-20-19(14-22(35)29(37)27(20)28(21)36)15-24-31(39)26(33(41)43-24)18-9-5-2-6-10-18/h1-15,35,37-39H,(H,34,36)/b23-13-,24-15-
InChIKeySVHJXZGURWMLIW-YVPQSAQRSA-N
Species of MetaboliteComponentSourceComments
Tricholoma aurantium (ncbitaxon:181708) - DOI (10.1002/(sici)1099-0690(200002)2000:4<603::aid-ejoc603>3.0.co;2-5)
ChEBI Ontology
Outgoing Relation(s)
Aurantricholone (CHEBI:211865) is a cyclic ketone (CHEBI:3992)
IUPAC Name 
(5Z)-4-hydroxy-3-phenyl-5-[[3,4,6-trihydroxy-1-[(Z)-(3-hydroxy-5-oxo-4-phenyluran-2-ylidene)methyl]-5-oxobenzo[7]annulen-8-yl]methylidene]uran-2-one
Manual XrefsDatabases
78435108ChemSpider