Mycelianamide (CHEBI:212287)

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CHEBI:212287 - Mycelianamide

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ChEBI ID	CHEBI:212287
ChEBI Name	Mycelianamide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H28N2O5
Net Charge	0
Average Mass	400.475
Monoisotopic Mass	400.19982
SMILES	CC(C)=CCC/C(C)=C/COc1ccc(/C=C2\C(=O)N(O)[C@@H](C)C(=O)N2O)cc1
InChI	InChI=1S/C22H28N2O5/c1-15(2)6-5-7-16(3)12-13-29-19-10-8-18(9-11-19)14-20-22(26)23(27)17(4)21(25)24(20)28/h6,8-12,14,17,27-28H,5,7,13H2,1-4H3/b16-12+,20-14+/t17-/m0/s1
InChIKey	JIGPABZIAJWQNM-MSODBRDKSA-N

Species of Metabolite	Component	Source	Comments
Penicillium griseofulvum (ncbitaxon:5078)	-	DOI (10.1039/jr9560003717)

ChEBI Ontology

Outgoing Relation(s)
	Mycelianamide (CHEBI:212287) is a monoterpenoid (CHEBI:25409)

IUPAC Name
(3E,6S)-3-[[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]methylidene]-1,4-dihydroxy-6-methylpiperazine-2,5-dione

Manual Xrefs	Databases
4940865	ChemSpider