4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane (CHEBI:218822)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:218822 - 4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane

Take structure to advanced search

ChEBI ID	CHEBI:218822
ChEBI Name	4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C9H18S5
Net Charge	0
Average Mass	286.578
Monoisotopic Mass	286.00121
SMILES	CC(C)CC1SSSC(C(C)C)SS1
InChI	InChI=1S/C9H18S5/c1-6(2)5-8-10-12-9(7(3)4)13-14-11-8/h6-9H,5H2,1-4H3
InChIKey	YSEIBZFKVFYBDW-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Thermococcusspecies (ncbitaxon:35749)	-	DOI (10.1002/jlac.1993199301138)

ChEBI Ontology

Outgoing Relation(s)
	4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane (CHEBI:218822) is a organic trisulfide (CHEBI:78493)

IUPAC Name
4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane

Manual Xrefs	Databases
10475730	ChemSpider