Epicoccarine A (CHEBI:217132)

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CHEBI:217132 - Epicoccarine A

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ChEBI ID	CHEBI:217132
ChEBI Name	Epicoccarine A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H31NO4
Net Charge	0
Average Mass	385.504
Monoisotopic Mass	385.22531
SMILES	CC/C=C(\C)C[C@H](C)C[C@H](C)/C(O)=C1/C(=O)N[C@@H](Cc2ccc(O)cc2)C1=O
InChI	InChI=1S/C23H31NO4/c1-5-6-14(2)11-15(3)12-16(4)21(26)20-22(27)19(24-23(20)28)13-17-7-9-18(25)10-8-17/h6-10,15-16,19,25-26H,5,11-13H2,1-4H3,(H,24,28)/b14-6+,21-20-/t15-,16-,19-/m0/s1
InChIKey	KGVANRZKBPUYPV-PWFBFJQWSA-N

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

ChEBI Ontology

Outgoing Relation(s)
	Epicoccarine A (CHEBI:217132) is a phenols (CHEBI:33853)

IUPAC Name
(3Z,5S)-5-[(4-hydroxyphenyl)methyl]-3-[(E,2S,4R)-1-hydroxy-2,4,6-trimethylnon-6-enylidene]pyrrolidine-2,4-dione

Manual Xrefs	Databases
78438135	ChemSpider