CHEBI:185008 - Tupichinol A

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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 Tupichinol A
ChEBI ID CHEBI:185008
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H18O4
Net Charge 0
Average Mass 286.327
Monoisotopic Mass 286.12051
InChI InChI=1S/C17H18O4/c1-10-15(20-2)8-5-12-9-14(19)17(21-16(10)12)11-3-6-13(18)7-4-11/h3-8,14,17-19H,9H2,1-2H3/t14-,17-/m1/s1
InChIKey PSCVPMJLJOIQKC-RHSMWYFYSA-N
SMILES O1[C@@H]([C@H](O)CC2=C1C(=C(OC)C=C2)C)C3=CC=C(O)C=C3
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 Tupichinol A (CHEBI:185008) is a ether (CHEBI:25698)
Tupichinol A (CHEBI:185008) is a flavonoids (CHEBI:72544)
IUPAC Name
(2R,3R)-2-(4-hydroxyphenyl)-7-methoxy-8-methyl-3,4-dihydro-2H-chromen-3-ol
Manual Xrefs Databases
553462 ChemSpider
LMPK12020006 LIPID MAPS
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