CHEBI:186679 - Cycloaltilisin 7

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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 Cycloaltilisin 7
ChEBI ID CHEBI:186679
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H26O5
Net Charge 0
Average Mass 406.478
Monoisotopic Mass 406.17802
InChI InChI=1S/C25H26O5/c1-15(2)5-4-11-25(3)12-10-18-22(30-25)14-20(28)23-19(27)13-21(29-24(18)23)16-6-8-17(26)9-7-16/h5-10,12,14,21,26,28H,4,11,13H2,1-3H3
InChIKey VSBUTPUUSVOZDI-UHFFFAOYSA-N
SMILES O1C(CCC=C(C)C)(C=CC2=C1C=C(O)C3=C2OC(CC3=O)C4=CC=C(O)C=C4)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 Cycloaltilisin 7 (CHEBI:186679) is a extended flavonoid (CHEBI:71037)
IUPAC Name
5-hydroxy-2-(4-hydroxyphenyl)-8-methyl-8-(4-methylpent-3-enyl)-2,3-dihydropyrano[2,3-h]chromen-4-one
Manual Xrefs Databases
9986259 ChemSpider
LMPK12140317 LIPID MAPS
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