CHEBI:180251 - 4-Methoxylonchocarpin

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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 4-Methoxylonchocarpin
ChEBI ID CHEBI:180251
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C21H20O4
Net Charge 0
Average Mass 336.387
Monoisotopic Mass 336.13616
InChI InChI=1S/C21H20O4/c1-21(2)13-12-17-19(25-21)11-9-16(20(17)23)18(22)10-6-14-4-7-15(24-3)8-5-14/h4-13,23H,1-3H3/b10-6+
InChIKey XEVCTBKORYCFCZ-UXBLZVDNSA-N
SMILES O1C(C=CC2=C1C=CC(=C2O)C(=O)/C=C/C3=CC=C(OC)C=C3)(C)C
ChEBI Ontology
Outgoing 4-Methoxylonchocarpin (CHEBI:180251) is a chalcones (CHEBI:23086)
IUPAC Name
(E)-1-(5-hydroxy-2,2-dimethylchromen-6-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
Manual Xrefs Databases
8647600 ChemSpider
LMPK12120079 LIPID MAPS
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Registry Number Type Source
51589-67-4 CAS Registry Number ChemIDplus