Sekothrixide (CHEBI:211500)

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CHEBI:211500 - Sekothrixide

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ChEBI ID	CHEBI:211500
ChEBI Name	Sekothrixide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H50O6
Net Charge	0
Average Mass	482.702
Monoisotopic Mass	482.36074
SMILES	CCC(O)C(C)C(O)C(C)C(O)C(C)C1C/C=C(/C)CC(C)CC(C)CC(C)C(=O)CC(=O)O1
InChI	InChI=1S/C28H50O6/c1-9-23(29)20(6)27(32)22(8)28(33)21(7)25-11-10-16(2)12-17(3)13-18(4)14-19(5)24(30)15-26(31)34-25/h10,17-23,25,27-29,32-33H,9,11-15H2,1-8H3/b16-10-
InChIKey	KJKRQOTYPMAJRP-YBEGLDIGSA-N

Species of Metabolite	Component	Source	Comments
Myxococcus stipitatus (ncbitaxon:83455)	-	PubMed (1761428)

ChEBI Ontology

Outgoing Relation(s)
	Sekothrixide (CHEBI:211500) is a diterpene lactone (CHEBI:49193)

IUPAC Name
(11Z)-5,7,9,11-tetramethyl-14-(3,5,7-trihydroxy-4,6-dimethylnonan-2-yl)-1-oxacyclotetradec-11-ene-2,4-dione

Manual Xrefs	Databases
4943829	ChemSpider