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CHEBI:200150 - 2S,3R,7S-trihydroxy-carophyllan-[4,7]-6,8-oxide

ChEBI IDCHEBI:200150
ChEBI Name2S,3R,7S-trihydroxy-carophyllan-[4,7]-6,8-oxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O4
Net Charge0
Average Mass268.353
Monoisotopic Mass268.16746
SMILESC=C1[C@H]2CC(C)(C)[C@H]2[C@H](O)[C@H](O)[C@]2(C)CCO[C@@]12O
InChIInChI=1S/C15H24O4/c1-8-9-7-13(2,3)10(9)11(16)12(17)14(4)5-6-19-15(8,14)18/h9-12,16-18H,1,5-7H2,2-4H3/t9-,10-,11+,12+,14+,15+/m1/s1
InChIKeyQTERRUCSFKBRCE-QIWTVSAUSA-N
Species of MetaboliteComponentSourceComments
Marasmiellus (ncbitaxon:71896) - DOI (10.1016/j.tetlet.2010.08.036)
ChEBI Ontology
Outgoing Relation(s)
2S,3R,7S-trihydroxy-carophyllan-[4,7]-6,8-oxide (CHEBI:200150) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1S,3S,6S,7S,8R,9S)-5,5,9-trimethyl-2-methylidene-12-oxatricyclo[7.3.0.03,6]dodecane-1,7,8-triol
Manual XrefsDatabases
28288088ChemSpider