EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:203963 - Guignarderemophilane D

ChEBI IDCHEBI:203963
ChEBI NameGuignarderemophilane D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCC(C)=C1C[C@@]2(C)C(=CC1=O)[C@@H](O)[C@H](O)[C@H](O)[C@@H]2C
InChIInChI=1S/C15H22O4/c1-7(2)9-6-15(4)8(3)12(17)14(19)13(18)10(15)5-11(9)16/h5,8,12-14,17-19H,6H2,1-4H3/t8-,12+,13+,14+,15+/m0/s1
InChIKeyCKEATZFCOZVTMU-LMYWXWJPSA-N
Species of MetaboliteComponentSourceComments
Phyllosticta capitalensis (ncbitaxon:121624) - PubMed (26241103)
ChEBI Ontology
Outgoing Relation(s)
Guignarderemophilane D (CHEBI:203963) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(4aR,5R,6R,7R,8R)-6,7,8-trihydroxy-4a,5-dimethyl-3-propan-2-ylidene-5,6,7,8-tetrahydro-4H-naphthalen-2-one
Manual XrefsDatabases
59002550ChemSpider