Lagriene (CHEBI:220291)

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CHEBI:220291 - Lagriene

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ChEBI ID	CHEBI:220291
ChEBI Name	Lagriene
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C44H74O11
Net Charge	0
Average Mass	779.065
Monoisotopic Mass	778.52311
SMILES	COC1C/C=C\C=C\CC(C)C(O)CC(O)C(C)C(O)CC(=O)OC(/C=C(\C)CC/C=C/C=C/CC(O)CC(C)CCC(=O)O)C(C)C(O)CC(O)CCC1
InChI	InChI=1S/C44H74O11/c1-30(17-12-8-7-9-14-19-35(45)25-31(2)23-24-43(51)52)26-42-34(5)39(48)27-36(46)20-16-22-37(54-6)21-15-11-10-13-18-32(3)38(47)28-40(49)33(4)41(50)29-44(53)55-42/h7-11,13-15,26,31-42,45-50H,12,16-25,27-29H2,1-6H3,(H,51,52)/b8-7+,13-10+,14-9+,15-11-,30-26+
InChIKey	TVZBMZKPHBNMGB-SMUIZACESA-N

Species of Metabolite	Component	Source	Comments
Burkholderia (ncbitaxon:32008)	-	PubMed (28452358)

ChEBI Ontology

Outgoing Relation(s)
	Lagriene (CHEBI:220291) is a macrolide (CHEBI:25106)