CHEBI:186546 - Lupinisoflavone D

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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 Lupinisoflavone D
ChEBI ID CHEBI:186546
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H18O7
Net Charge 0
Average Mass 370.357
Monoisotopic Mass 370.10525
InChI InChI=1S/C20H18O7/c1-20(2,25)16-7-11-14(27-16)4-3-10(18(11)23)12-8-26-15-6-9(21)5-13(22)17(15)19(12)24/h3-6,8,16,21-23,25H,7H2,1-2H3
InChIKey FEZXFNWSKGIOKM-UHFFFAOYSA-N
SMILES O1C(C(O)(C)C)CC2=C1C=CC(=C2O)C=3C(=O)C=4C(OC3)=CC(O)=CC4O
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 Lupinisoflavone D (CHEBI:186546) is a isoflavones (CHEBI:38757)
IUPAC Name
5,7-dihydroxy-3-[4-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzouran-5-yl]chromen-4-one
Manual Xrefs Databases
4527528 ChemSpider
LMPK12050277 LIPID MAPS
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