EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:177684 - Tinabinol

ChEBI IDCHEBI:177684
ChEBI NameTinabinol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H34O2S
Net Charge0
Average Mass374.590
Monoisotopic Mass374.22795
SMILESCCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCCS1
InChIInChI=1S/C23H34O2S/c1-6-7-8-10-15(2)16(3)17-13-19(24)21-18-11-9-12-26-22(18)23(4,5)25-20(21)14-17/h13-16,24H,6-12H2,1-5H3
InChIKeyYCNTYPIGYVTFBO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Tinabinol (CHEBI:177684) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
5,5-dimethyl-8-(3-methyloctan-2-yl)-2,3-dihydro-1H-thiopyrano[2,3-c]chromen-10-ol
Manual XrefsDatabases
D06153KEGG DRUG
58905ChemSpider
Registry NumbersSources
CAS:50708-95-7ChemIDplus