CHEBI:187818 - Kushenol B

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ChEBI Name Kushenol B
ChEBI ID CHEBI:187818
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H36O6
Net Charge 0
Average Mass 492.612
Monoisotopic Mass 492.25119
InChI InChI=1S/C30H36O6/c1-16(2)7-9-19(18(5)6)13-23-28(34)22(11-8-17(3)4)29(35)27-25(33)15-26(36-30(23)27)21-12-10-20(31)14-24(21)32/h7-8,10,12,14,19,26,31-32,34-35H,5,9,11,13,15H2,1-4,6H3
InChIKey CDNAGJNJVFLMRS-UHFFFAOYSA-N
SMILES O1C2=C(CC(CC=C(C)C)C(C)=C)C(O)=C(C(O)=C2C(=O)CC1C3=C(O)C=C(O)C=C3)CC=C(C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Kushenol B (CHEBI:187818) is a flavanones (CHEBI:28863)
IUPAC Name
2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)-8-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)-2,3-dihydrochromen-4-one
Manual Xrefs Databases
4477348 ChemSpider
LMPK12140465 LIPID MAPS
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