Vermiculine (CHEBI:224091)

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CHEBI:224091 - Vermiculine

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ChEBI ID	CHEBI:224091
ChEBI Name	Vermiculine
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H24O8
Net Charge	0
Average Mass	392.404
Monoisotopic Mass	392.14712
SMILES	CC(=O)CC1CCC(=O)/C=C/C(=O)OC(CC(C)=O)CCC(=O)C=CC(=O)O1
InChI	InChI=1S/C20H24O8/c1-13(21)11-17-7-3-15(23)6-10-20(26)28-18(12-14(2)22)8-4-16(24)5-9-19(25)27-17/h5-6,9-10,17-18H,3-4,7-8,11-12H2,1-2H3/b9-5+,10-6?
InChIKey	CFDVIOQSLRJWSU-IIWBTEQSSA-N

Species of Metabolite	Component	Source	Comments
Talaromyces flavus var. flavus (ncbitaxon:184875)	-	PubMed (4559271)

ChEBI Ontology

Outgoing Relation(s)
	Vermiculine (CHEBI:224091) is a macrolide (CHEBI:25106)

IUPAC Name
(3E)-8,16-bis(2-oxopropyl)-1,9-dioxacyclohexadeca-3,11-diene-2,5,10,13-tetrone