EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:210815 - Trichobisabolin B

ChEBI IDCHEBI:210815
ChEBI NameTrichobisabolin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCC1=CC(C[C@@H](C)[C@H]2C=C[C@](C)(O)CC2)OC1=O
InChIInChI=1S/C15H22O3/c1-10(8-13-9-11(2)14(16)18-13)12-4-6-15(3,17)7-5-12/h4,6,9-10,12-13,17H,5,7-8H2,1-3H3/t10-,12+,13?,15+/m1/s1
InChIKeyDCLJMBAXVKHPKN-SUTJQRNSSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (30878292)
ChEBI Ontology
Outgoing Relation(s)
Trichobisabolin B (CHEBI:210815) is a terpene lactone (CHEBI:37668)
IUPAC Name 
2-[(2R)-2-[(1S,4R)-4-hydroxy-4-methylcyclohex-2-en-1-yl]propyl]-4-methyl-2H-uran-5-one
Manual XrefsDatabases
77001455ChemSpider