CHEBI:208248 - Aspulvinone R

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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 Aspulvinone R
ChEBI ID CHEBI:208248
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H14O7
Net Charge 0
Average Mass 342.303
Monoisotopic Mass 342.07395
InChI InChI=1S/C18H14O7/c1-24-13-7-9(6-12(20)16(13)21)8-14-17(22)15(18(23)25-14)10-2-4-11(19)5-3-10/h2-8,19-22H,1H3/b14-8-
InChIKey MYJVNAXQWDAVRD-ZSOIEALJSA-N
SMILES O=C1O/C(=C\C2=CC(OC)=C(O)C(=C2)O)/C(=C1C3=CC=C(O)C=C3)O
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: DOI
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing Aspulvinone R (CHEBI:208248) is a methoxybenzenes (CHEBI:51683)
Aspulvinone R (CHEBI:208248) is a phenols (CHEBI:33853)
IUPAC Names
(5Z)-5-[(3,4-dihydroxy-5-methoxyphenyl)methylidene]-4-hydroxy-3-(4-hydroxyphenyl)uran-2-one
3-[2,4-dihydroxy-5-(3-hydroxy-3-methylbutyl)phenyl]-4-hydroxy-5-[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methylidene]uran-2-one
Manual Xref Database
78435776 ChemSpider
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