CHEBI:199654 - Rubasperone A

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ChEBI Name Rubasperone A
ChEBI ID CHEBI:199654
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C31H24O10
Net Charge 0
Average Mass 556.523
Monoisotopic Mass 556.13695
InChI InChI=1S/C31H24O10/c1-12-6-17(32)27-22(40-12)10-16-23(19(34)11-21(39-5)25(16)29(27)35)26-15-8-14(37-3)9-20(38-4)24(15)30(36)28-18(33)7-13(2)41-31(26)28/h6-11,34-36H,1-5H3
InChIKey IPLCYZORHREOKF-UHFFFAOYSA-N
SMILES O=C1C=2C(OC(=C1)C)=C(C3=C(O)C=C(OC)C=4C3=CC=5OC(C)=CC(C5C4O)=O)C6=CC(OC)=CC(=C6C2O)OC
Metabolite of Species Details
Aspergillus tubingensis (NCBI:txid5068) See: PubMed
ChEBI Ontology
Outgoing Rubasperone A (CHEBI:199654) is a organic heterotricyclic compound (CHEBI:26979)
Rubasperone A (CHEBI:199654) is a organooxygen compound (CHEBI:36963)
IUPAC Name
5,8-dihydroxy-9-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-6-methoxy-2-methylbenzo[g]chromen-4-one
Manual Xref Database
27025318 ChemSpider
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