Epipyridone (CHEBI:223932)

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CHEBI:223932 - Epipyridone

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ChEBI ID	CHEBI:223932
ChEBI Name	Epipyridone
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H29NO3
Net Charge	0
Average Mass	367.489
Monoisotopic Mass	367.21474
SMILES	CC[C@H]1Oc2c(-c3ccc(O)cc3)cnc(=O)c2[C@H]2[C@H](C)C[C@H](C)C[C@]12C
InChI	InChI=1S/C23H29NO3/c1-5-18-23(4)11-13(2)10-14(3)20(23)19-21(27-18)17(12-24-22(19)26)15-6-8-16(25)9-7-15/h6-9,12-14,18,20,25H,5,10-11H2,1-4H3,(H,24,26)/t13-,14+,18+,20+,23+/m0/s1
InChIKey	ZUJBUMRATOLVJT-VIBJKCLASA-N

Species of Metabolite	Component	Source	Comments
Epicoccumspecies (ncbitaxon:1859956)	-	PubMed (17520137)

ChEBI Ontology

Outgoing Relation(s)
	Epipyridone (CHEBI:223932) is a pyridochromene (CHEBI:53792)

IUPAC Name
(6R,6aS,8S,10R,10aS)-6-ethyl-4-(4-hydroxyphenyl)-6a,8,10-trimethyl-6,7,8,9,10,10a-hexahydro-2H-isochromeno[4,3-c]pyridin-1-one

Manual Xrefs	Databases
17597258	ChemSpider