CHEBI:183741 - Radicinin

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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 Radicinin
ChEBI ID CHEBI:183741
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H12O5
Net Charge 0
Average Mass 236.223
Monoisotopic Mass 236.06847
InChI InChI=1S/C12H12O5/c1-3-4-7-5-8-9(12(15)17-7)11(14)10(13)6(2)16-8/h3-6,10,13H,1-2H3/b4-3+/t6-,10-/m0/s1
InChIKey SDKXGAICTNHFCN-DCJAWTJCSA-N
SMILES O1[C@H]([C@H](O)C(=O)C2=C1C=C(OC2=O)/C=C/C)C
Metabolite of Species Details
Bombus terrestris (NCBI:txid30195) Found in hemolymph (BTO:0000572). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195) Found in hindgut (BTO:0000510). See: MetaboLights Study
ChEBI Ontology
Outgoing Radicinin (CHEBI:183741) is a aromatic ketone (CHEBI:76224)
IUPAC Name
(2S,3S)-3-hydroxy-2-methyl-7-[(E)-prop-1-enyl]-2,3-dihydropyrano[3,2-c]pyran-4,5-dione
Manual Xref Database
4529404 ChemSpider
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Registry Number Type Source
10088-95-6 CAS Registry Number ChemIDplus