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CHEBI:209904 - Trieffusol A

ChEBI IDCHEBI:209904
ChEBI NameTrieffusol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O8
Net Charge0
Average Mass430.453
Monoisotopic Mass430.16277
SMILESCC[C@@]1(O)C(=O)C2=C(C[C@@H]1O)OC1=C(C(=O)[C@@](O)(CC)[C@@H](O)C1)C2c1ccc(O)cc1
InChIInChI=1S/C23H26O8/c1-3-22(29)15(25)9-13-18(20(22)27)17(11-5-7-12(24)8-6-11)19-14(31-13)10-16(26)23(30,4-2)21(19)28/h5-8,15-17,24-26,29-30H,3-4,9-10H2,1-2H3/t15-,16-,17?,22-,23+/m0/s1
InChIKeyNTXVNAGRTLWEJY-NRRSLPSTSA-N
Species of MetaboliteComponentSourceComments
Trichobotrys (ncbitaxon:1520156) - PubMed (32111022)
ChEBI Ontology
Outgoing Relation(s)
Trieffusol A (CHEBI:209904) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(2R,3S,6S,7S)-2,7-diethyl-2,3,6,7-tetrahydroxy-9-(4-hydroxyphenyl)-4,5,6,9-tetrahydro-3H-xanthene-1,8-dione