CHEBI:211865 - Aurantricholone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Aurantricholone
ChEBI ID CHEBI:211865
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C33H20O10
Net Charge 0
Average Mass 576.513
Monoisotopic Mass 576.10565
InChI InChI=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-
InChIKey SVHJXZGURWMLIW-YVPQSAQRSA-N
SMILES O=C1C(O)=CC(/C=C/2\OC(=O)C(=C2O)C3=CC=CC=C3)=CC=4C1=C(O)C(O)=CC4/C=C/5\OC(=O)C(=C5O)C6=CC=CC=C6
Metabolite of Species Details
Tricholoma aurantium (NCBI:txid181708) See: DOI
ChEBI Ontology
Outgoing 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 Xref Database
78435108 ChemSpider
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