N-[4-(2-formyl-5-hydroxymethyl-pyrrol-1-yl)-butyl]-acetamide (CHEBI:206961)

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CHEBI:206961 - N-[4-(2-formyl-5-hydroxymethyl-pyrrol-1-yl)-butyl]-acetamide

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ChEBI ID	CHEBI:206961
ChEBI Name	N-[4-(2-formyl-5-hydroxymethyl-pyrrol-1-yl)-butyl]-acetamide
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Submitter	MetaboLights
Downloads	Molfile

Formula	C12H18N2O3
Net Charge	0
Average Mass	238.287
Monoisotopic Mass	238.13174
SMILES	CC(=O)NCCCCn1c(C=O)ccc1CO
InChI	InChI=1S/C12H18N2O3/c1-10(17)13-6-2-3-7-14-11(8-15)4-5-12(14)9-16/h4-5,8,16H,2-3,6-7,9H2,1H3,(H,13,17)
InChIKey	KWGYXNAQPYHRSW-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Fusarium (ncbitaxon:5506)	-	PubMed (18696331)

ChEBI Ontology

Outgoing Relation(s)
	N-[4-(2-formyl-5-hydroxymethyl-pyrrol-1-yl)-butyl]-acetamide (CHEBI:206961) is a arenecarbaldehyde (CHEBI:33855)

IUPAC Name
N-[4-[2-ormyl-5-(hydroxymethyl)pyrrol-1-yl]butyl]acetamide

Manual Xrefs	Databases
78435740	ChemSpider