CHEBI:190090 - Brosimone H

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ChEBI Name Brosimone H
ChEBI ID CHEBI:190090
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H36O6
Net Charge 0
Average Mass 504.623
Monoisotopic Mass 504.25119
InChI InChI=1S/C31H36O6/c1-18(2)8-7-9-20(5)11-14-23-27(36-6)17-26(34)28-29(35)24(13-10-19(3)4)30(37-31(23)28)22-15-12-21(32)16-25(22)33/h8,10-12,15-17,32-34H,7,9,13-14H2,1-6H3/b20-11+
InChIKey HLKOYMOJPUHOBW-RGVLZGJSSA-N
SMILES O1C=2C(C/C=C(/CCC=C(C)C)\C)=C(OC)C=C(O)C2C(=O)C(=C1C3=C(O)C=C(O)C=C3)CC=C(C)C
Metabolite of Species Details
Brassica napus (NCBI:txid3708) Found in flower (BTO:0000469). See: MetaboLights Study
ChEBI Ontology
Outgoing Brosimone H (CHEBI:190090) is a flavones (CHEBI:24043)
IUPAC Name
2-(2,4-dihydroxyphenyl)-8-[(2E)-3,7-dimethylocta-2,6-dienyl]-5-hydroxy-7-methoxy-3-(3-methylbut-2-enyl)chromen-4-one
Manual Xrefs Databases
24843903 ChemSpider
LMPK12110899 LIPID MAPS
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