4alpha-(3,5-dihydroxy-heptyl)-3alpha-methyl-2-oxetanone (CHEBI:211896)

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CHEBI:211896 - 4alpha-(3,5-dihydroxy-heptyl)-3alpha-methyl-2-oxetanone

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ChEBI ID	CHEBI:211896
ChEBI Name	4alpha-(3,5-dihydroxy-heptyl)-3alpha-methyl-2-oxetanone
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C11H20O4
Net Charge	0
Average Mass	216.277
Monoisotopic Mass	216.13616
SMILES	CCC(O)CC(O)CC[C@H]1OC(=O)[C@@H]1C
InChI	InChI=1S/C11H20O4/c1-3-8(12)6-9(13)4-5-10-7(2)11(14)15-10/h7-10,12-13H,3-6H2,1-2H3/t7-,8?,9?,10-/m1/s1
InChIKey	VPQIWJPLJXTRDO-SEZDTBSWSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies T1B1 (ncbitaxon:1285899)	-	DOI (10.1016/j.phytol.2013.08.007)

ChEBI Ontology

Outgoing Relation(s)
	4alpha-(3,5-dihydroxy-heptyl)-3alpha-methyl-2-oxetanone (CHEBI:211896) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name
(3R,4R)-4-(3,5-dihydroxyheptyl)-3-methyloxetan-2-one

Manual Xrefs	Databases
78441501	ChemSpider